data_2kym_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 2kym _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 ' 2' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.805 0.336 . . . . 74.15 110.926 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -133.22 146.11 51.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 73.41 110.949 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -122.56 153.47 39.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.187 -0.46 . . . . 64.12 111.103 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.5 p -123.27 130.22 74.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.21 -0.45 . . . . 70.33 111.118 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.26 138.17 47.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 62.24 111.182 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.4 mt -112.44 -12.02 13.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.254 -0.43 . . . . 74.23 110.95 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -137.69 154.81 49.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.185 -0.461 . . . . 75.41 110.931 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -81.94 104.73 12.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.127 -0.488 . . . . 71.41 110.893 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -109.61 102.87 11.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 73.31 110.845 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -78.99 136.32 37.18 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 75.22 110.88 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.32 161.2 11.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 63.13 111.102 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -124.6 -36.47 2.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 74.0 110.936 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -132.45 -177.88 4.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 74.41 110.886 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -65.67 -15.12 62.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.221 -0.445 . . . . 74.0 110.886 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -99.03 22.34 10.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 73.1 110.878 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.0 mp0 -136.87 142.85 42.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 74.42 110.843 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.5 tp -121.36 126.45 49.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.145 -0.48 . . . . 75.04 110.946 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -65.5 139.96 58.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.457 . . . . 73.44 110.83 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -142.47 158.44 19.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 74.53 111.17 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -127.17 159.85 62.87 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.649 0.738 . . . . 61.31 110.83 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 117.78 5.29 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.659 2.239 . . . . 72.24 112.373 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.5 7.12 30.47 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.718 -0.753 . . . . 44.45 112.448 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -91.91 162.49 14.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.857 0.36 . . . . 74.13 110.908 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -107.96 119.42 39.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 74.04 110.897 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.5 mt -120.98 154.29 36.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.195 -0.457 . . . . 75.22 110.946 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -109.03 115.94 31.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 72.33 110.844 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 35.4 mm -70.57 143.32 14.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.476 . . . . 73.43 111.149 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.9 m -124.5 -37.13 2.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 71.23 110.887 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -168.87 170.62 9.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 73.53 111.093 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -123.89 174.51 7.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 73.34 110.873 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -142.16 100.68 3.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 75.24 110.896 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 60.09 18.78 8.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.075 -0.511 . . . . 63.44 110.87 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 65.45 23.95 11.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.218 -0.446 . . . . 75.15 110.942 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.417 ' HB2' ' CD1' ' A' ' 36' ' ' TRP . 0.4 OUTLIER -116.92 -41.31 3.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.098 -0.501 . . . . 74.3 110.866 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.417 ' CD1' ' HB2' ' A' ' 35' ' ' GLU . 56.6 m95 -116.62 140.32 49.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.185 -0.461 . . . . 74.44 110.926 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -119.31 142.8 47.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 74.21 110.873 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 23.5 mm -96.27 95.44 4.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 74.55 111.103 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -109.06 136.38 48.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 60.41 111.099 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.8 pttt -111.46 157.73 38.31 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.621 0.724 . . . . 74.33 110.908 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 135.53 30.58 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.701 2.268 . . . . 73.2 112.367 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 79.3 mt . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.26 -0.427 . . . . 75.52 111.152 179.923 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo . . . . . 0 N--CA 1.466 -0.133 0 CA-C-O 120.806 0.253 . . . . 73.3 112.327 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.22 -143.29 4.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.771 -0.728 . . . . 70.44 112.504 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -146.17 124.86 12.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.893 0.378 . . . . 73.23 110.899 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.3 p -136.18 133.87 19.82 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.635 0.731 . . . . 74.22 111.14 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 153.18 69.22 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.664 2.243 . . . . 72.24 112.352 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 11.1 t -66.34 -21.74 29.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.245 -0.434 . . . . 75.15 111.164 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.1 m -77.94 -1.93 34.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.154 -0.475 . . . . 72.31 110.871 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -126.84 22.91 6.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.137 -0.483 . . . . 73.11 110.934 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.8 m -150.23 165.18 3.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.1 -0.5 . . . . 74.51 111.181 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 40.0 ttp85 -133.5 114.02 13.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.233 -0.44 . . . . 74.51 110.865 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 29.1 mm -69.37 127.34 31.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 74.32 111.129 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 24.7 pt -143.49 -178.22 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 73.41 111.132 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -131.44 132.67 44.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.467 . . . . 62.12 110.838 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.6 mt -59.28 -21.84 60.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 73.43 110.974 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.1 mtm -90.04 -30.21 17.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.14 -0.482 . . . . 74.22 110.903 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -152.19 75.69 7.27 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.584 0.707 . . . . 74.45 110.855 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.82 -11.12 30.11 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.64 2.226 . . . . 74.1 112.308 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.07 -5.56 47.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.241 -0.436 . . . . 65.22 111.107 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.3 ttmm -83.06 -51.12 7.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 73.4 110.916 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -99.76 23.23 9.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.232 -0.44 . . . . 64.34 110.921 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -87.03 -20.88 26.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.484 . . . . 72.44 111.118 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.0 t -92.85 -21.06 20.09 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.2 -0.455 . . . . 72.43 110.865 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 7.6 p -51.55 152.27 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.495 . . . . 75.11 111.151 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -104.18 91.33 3.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 60.23 110.903 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -51.6 -35.66 42.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 75.3 111.136 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -58.02 -43.98 87.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.221 -0.445 . . . . 72.0 110.969 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -63.83 107.98 1.35 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.094 -0.503 . . . . 62.12 110.846 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.28 -28.46 19.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 75.54 110.851 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -66.73 -55.0 17.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 63.24 110.896 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -59.58 -56.35 23.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 74.21 110.891 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 4.2 p -53.44 -32.34 20.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 75.32 111.152 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 9.8 mtm -67.41 -54.51 19.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 73.53 110.879 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.83 -37.91 69.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.263 -0.426 . . . . 75.54 110.863 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 84.4 mt -66.12 -53.46 36.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 72.33 111.155 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 96.4 mt -61.86 -36.21 72.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.459 . . . . 74.2 111.124 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 61.1 t0 -71.05 -48.26 53.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 71.35 110.864 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -60.88 -53.89 51.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 74.44 110.896 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -69.21 -11.96 61.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.475 . . . . 74.42 110.9 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt 58.45 54.53 5.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 74.25 110.872 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 20.5 mt -81.06 131.61 59.08 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.638 0.733 . . . . 73.31 111.094 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 159.04 54.84 Favored 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.675 2.25 . . . . 64.11 112.384 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -92.84 170.0 10.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 75.21 111.188 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 98.4 t -52.04 -58.07 2.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.28 -0.418 . . . . 71.52 111.074 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -51.54 -51.86 51.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.451 . . . . 73.35 110.881 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 51.5 mm-40 -57.23 -38.56 73.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.136 -0.484 . . . . 71.3 110.971 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 24.2 t90 -66.39 -43.3 86.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.169 -0.469 . . . . 75.12 110.929 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -61.54 -47.92 83.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 73.32 110.927 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -64.69 -39.93 94.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.436 . . . . 74.42 110.886 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -60.39 -49.24 78.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.454 . . . . 74.43 110.94 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.444 . . . . 75.04 111.121 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.893 0.378 . . . . 75.43 110.891 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 26.7 mm -110.82 81.64 2.65 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.631 0.729 . . . . 71.53 111.087 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 78.46 1.0 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.667 2.245 . . . . 75.2 112.333 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 29.7 m -82.5 0.31 43.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.254 -0.43 . . . . 71.4 110.857 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 2.1 mpp_? -67.63 162.17 59.57 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.552 0.692 . . . . 74.23 110.864 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 158.88 55.48 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.651 2.234 . . . . 61.32 112.411 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -91.37 111.94 51.51 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.55 0.69 . . . . 75.24 111.101 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 149.84 67.23 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.65 2.233 . . . . 72.4 112.355 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 17.0 mtmt -99.89 161.18 25.18 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.598 0.713 . . . . 74.44 110.913 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 168.25 22.07 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.7 2.267 . . . . 75.22 112.336 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--N 1.341 0.181 0 C-N-CA 122.627 2.218 . . . . 71.14 112.368 179.962 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 pt? . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.813 0.34 . . . . 75.22 110.917 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -115.26 153.68 30.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.178 -0.464 . . . . 65.12 110.892 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -129.47 152.88 48.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 72.03 111.14 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 p -120.49 125.65 74.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.261 -0.427 . . . . 75.14 111.127 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.95 131.39 45.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 75.05 111.105 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 71.3 mt -102.36 -17.87 15.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 75.44 110.918 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -133.96 157.14 46.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 75.54 110.963 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -82.55 105.28 13.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 74.21 110.878 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -84.64 105.05 15.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.117 -0.492 . . . . 72.42 110.88 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.5 mttp -81.22 97.82 7.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 74.14 110.871 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.36 140.35 22.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 54.51 111.106 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -107.06 -28.86 9.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 63.34 110.89 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -129.77 -179.25 5.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.466 . . . . 75.23 110.868 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -65.02 -36.9 85.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 75.01 110.859 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -63.25 -34.91 78.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.167 -0.47 . . . . 70.14 110.88 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -77.16 140.7 40.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.179 -0.464 . . . . 72.13 110.922 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 12.3 tp -112.54 127.2 56.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.155 -0.475 . . . . 74.05 110.937 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 -72.89 125.22 27.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.247 -0.433 . . . . 74.32 110.838 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 10.1 p -138.78 152.65 24.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 74.23 111.106 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -114.41 159.64 35.98 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.673 0.749 . . . . 74.34 110.859 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 123.18 9.83 Favored 'Trans proline' 0 C--N 1.341 0.143 0 C-N-CA 122.672 2.248 . . . . 73.13 112.346 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.09 4.53 31.12 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.696 -0.764 . . . . 62.21 112.47 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -92.01 165.1 13.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.842 0.353 . . . . 73.41 110.91 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -110.75 128.37 55.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.151 -0.477 . . . . 74.02 110.915 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.1 mt -128.24 146.48 50.72 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.188 -0.46 . . . . 74.32 110.902 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.25 123.26 39.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 74.22 110.891 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 34.3 mm -70.12 144.49 13.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.468 . . . . 63.42 111.146 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 21.8 m -125.77 -37.48 2.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 74.33 110.879 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -179.11 171.54 1.34 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 71.01 111.121 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -124.25 176.85 6.16 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 71.44 110.876 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.5 t80 -148.03 102.78 3.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 73.31 110.942 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 60.16 18.64 8.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.139 -0.482 . . . . 74.54 110.883 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 61.79 20.23 11.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 75.3 110.922 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -119.47 -3.81 10.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.113 -0.494 . . . . 72.13 110.863 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 90.5 m95 -151.57 135.8 16.74 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.148 -0.478 . . . . 75.01 110.893 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -120.06 145.64 46.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.231 -0.44 . . . . 70.44 110.887 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.8 mm -100.83 95.12 3.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.122 -0.49 . . . . 75.14 111.119 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -110.18 134.91 51.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.469 . . . . 73.12 111.107 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.8 pttt -111.34 156.75 40.68 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.59 0.71 . . . . 74.11 110.885 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 115.44 4.1 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.722 2.281 . . . . 74.4 112.313 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 55.1 mt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 73.21 111.142 179.947 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--O 1.23 0.083 0 CA-C-O 120.825 0.26 . . . . 71.13 112.31 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -133.68 -156.8 8.09 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.744 -0.741 . . . . 41.23 112.496 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.7 tt -131.11 124.86 31.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.797 0.332 . . . . 72.54 110.953 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.3 p -137.23 133.46 18.37 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.613 0.72 . . . . 72.45 111.13 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 155.63 65.46 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.644 2.23 . . . . 72.22 112.341 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 9.4 t -68.39 -21.44 26.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.45 . . . . 74.43 111.134 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -77.24 -3.06 37.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.152 -0.476 . . . . 72.02 110.837 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -124.89 19.91 8.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.131 -0.486 . . . . 73.23 110.882 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.0 m -150.24 157.41 6.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.111 -0.495 . . . . 54.54 111.094 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 22.4 ttp180 -123.93 110.77 15.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 73.21 110.853 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 38.9 mm -64.69 121.37 13.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 74.02 111.135 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 14.8 pt -136.18 173.41 13.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.172 -0.467 . . . . 74.3 111.16 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -115.92 126.33 53.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 74.51 110.839 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.49 -29.34 24.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 74.31 110.95 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.82 -26.01 19.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.216 -0.447 . . . . 73.42 110.9 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -141.61 73.76 23.91 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.611 0.72 . . . . 74.43 110.878 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -8.97 24.97 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.691 2.26 . . . . 72.22 112.387 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -102.67 -17.61 15.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 74.33 111.116 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.9 ttmm -73.44 -51.9 15.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 73.11 110.918 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -95.43 23.03 6.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 75.12 110.948 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -86.99 -19.96 27.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.118 -0.492 . . . . 73.22 111.075 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 8.2 p -88.67 -19.92 25.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 75.54 110.822 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 7.0 p -51.53 148.28 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 73.51 111.125 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -105.82 89.44 3.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 75.15 110.862 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -51.32 -30.38 18.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 74.1 111.169 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -61.25 -48.5 81.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.187 -0.46 . . . . 65.01 110.909 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.85 112.57 2.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.159 -0.473 . . . . 75.11 110.877 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.42 -24.64 31.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.155 -0.475 . . . . 65.01 110.887 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -66.9 -54.01 26.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 74.44 110.885 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -59.83 -57.89 10.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 73.45 110.876 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 2.0 p -51.88 -32.21 14.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 74.52 111.144 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 9.9 mtm -68.11 -53.22 26.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 74.5 110.855 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.9 mttm -55.75 -38.14 69.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 73.14 110.884 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 30.0 mt -66.65 -55.63 17.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 72.1 111.154 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 93.0 mt -59.98 -36.78 69.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 52.54 111.137 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -71.22 -52.08 21.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 71.42 110.854 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -60.21 -51.16 70.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.161 -0.472 . . . . 72.52 110.876 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -70.03 -11.16 60.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 70.11 110.86 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 26.9 mmtt 58.12 49.19 11.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 75.12 110.856 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 14.2 mt -78.28 125.74 84.43 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.607 0.718 . . . . 73.14 111.13 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 158.3 57.43 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.682 2.255 . . . . 64.01 112.325 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.41 172.23 9.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 62.21 111.149 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.9 t -52.28 -51.69 30.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 74.23 111.111 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -51.6 -51.97 51.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 73.44 110.859 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 43.0 mm-40 -58.13 -40.77 82.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 72.4 110.956 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 23.6 t90 -64.89 -40.5 95.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 74.42 110.945 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.69 -52.45 60.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.233 -0.439 . . . . 73.4 110.88 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -59.18 -43.97 92.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 74.13 110.849 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -59.38 -48.81 80.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.462 . . . . 72.41 110.873 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.2 p . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.23 -0.441 . . . . 72.03 111.142 -179.905 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.781 0.324 . . . . 74.45 110.887 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.3 mm 51.81 77.08 0.48 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.57 0.7 . . . . 74.51 111.127 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 92.36 0.51 Allowed 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.654 2.236 . . . . 74.15 112.368 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 29.1 t -89.44 3.54 51.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 74.51 110.861 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.47 162.17 0.72 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.623 0.725 . . . . 74.02 110.861 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -16.16 37.65 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.653 2.236 . . . . 54.34 112.354 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.3 80.56 0.23 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.617 0.723 . . . . 70.41 111.113 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 154.1 68.1 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.691 2.261 . . . . 71.44 112.335 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -93.51 159.54 34.81 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.555 0.693 . . . . 73.11 110.87 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 166.8 26.41 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.685 2.256 . . . . 75.2 112.315 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo . . . . . 0 C--N 1.341 0.156 0 C-N-CA 122.731 2.287 . . . . 75.12 112.332 179.938 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.4 pp . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.817 0.341 . . . . 72.24 110.938 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -118.49 152.05 36.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.2 -0.454 . . . . 74.14 110.869 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -120.06 163.14 18.1 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 73.15 111.13 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.6 p -133.75 119.26 32.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 74.32 111.132 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.14 139.19 57.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.461 . . . . 73.12 111.127 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.0 mt -106.02 -18.37 14.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.265 -0.425 . . . . 73.35 110.941 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -139.06 163.9 31.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.168 -0.469 . . . . 74.32 110.945 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -80.44 113.45 18.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.114 -0.494 . . . . 73.11 110.908 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -98.17 111.57 23.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.217 -0.447 . . . . 74.54 110.853 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.05 121.01 26.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.491 . . . . 73.42 110.906 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.93 156.53 36.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 71.31 111.126 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -124.18 -37.69 2.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.257 -0.429 . . . . 70.34 110.891 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.7 mmt180 -128.85 178.92 6.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.179 -0.464 . . . . 72.34 110.87 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -55.84 -44.54 78.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.2 -0.455 . . . . 74.14 110.872 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -54.54 -51.91 63.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 75.51 110.883 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.55 147.94 39.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 74.05 110.858 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.3 tp -128.82 120.81 26.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.168 -0.469 . . . . 72.12 110.951 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -66.47 137.46 56.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.461 . . . . 75.23 110.859 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.2 p -153.15 146.07 14.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 74.24 111.09 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.6 m -103.42 160.47 26.04 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 121.735 0.779 . . . . 71.42 110.825 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 118.36 5.64 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.685 2.257 . . . . 73.25 112.334 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.02 5.02 31.08 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.717 -0.754 . . . . 72.33 112.499 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -92.18 156.87 17.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.893 0.378 . . . . 73.42 110.899 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -104.45 133.76 48.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.152 -0.476 . . . . 75.14 110.864 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.4 mp -133.82 149.47 51.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.475 . . . . 73.33 110.929 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.8 t -100.86 112.59 25.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 72.14 110.869 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 57.5 mt -77.02 150.83 5.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.133 -0.485 . . . . 73.31 111.15 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 34.0 m -125.85 -36.69 2.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 74.0 110.858 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.0 179.2 9.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.456 . . . . 55.33 111.069 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -132.82 178.21 7.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 72.53 110.806 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -137.8 99.09 3.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.167 -0.47 . . . . 72.44 110.947 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.9 t70 53.07 26.54 4.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.469 . . . . 73.24 110.862 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 62.85 26.06 15.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 65.33 110.903 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -114.48 -40.27 3.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.13 -0.487 . . . . 74.25 110.894 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -122.3 155.48 35.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.12 -0.491 . . . . 73.41 110.95 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -128.19 130.83 48.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 74.12 110.855 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.0 mm -91.33 94.12 4.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 71.34 111.128 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -116.23 157.07 25.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 74.12 111.116 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.3 pttp -123.25 156.84 62.8 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.564 0.697 . . . . 74.42 110.9 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 127.85 15.2 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.664 2.243 . . . . 74.41 112.401 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 60.1 mt . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 72.51 111.11 179.985 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo . . . . . 0 C--O 1.231 0.153 0 CA-C-O 120.805 0.252 . . . . 74.2 112.373 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -136.83 -120.51 1.95 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.713 -0.756 . . . . 54.41 112.443 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -159.45 125.9 4.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.832 0.348 . . . . 73.34 110.891 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.0 m -136.47 138.88 27.94 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.606 0.717 . . . . 65.53 111.134 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 130.01 18.57 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.664 2.243 . . . . 70.12 112.369 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 22.1 t -57.35 -21.69 15.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 71.24 111.132 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.4 p -74.34 -6.26 47.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 53.33 110.888 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -119.52 -25.27 6.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.101 -0.5 . . . . 72.52 110.893 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 1.3 t -106.16 138.69 30.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 73.3 111.105 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.8 ttp180 -111.2 123.64 50.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 71.51 110.855 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 24.2 mm -70.79 128.88 34.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 74.45 111.141 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 16.0 pt -145.69 174.12 3.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 72.24 111.129 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -117.84 130.19 56.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.186 -0.461 . . . . 74.44 110.872 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mt -58.04 -22.73 51.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 71.32 110.895 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.4 mmt -89.54 -27.93 19.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 73.53 110.899 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -152.58 75.84 6.95 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.659 0.743 . . . . 74.34 110.857 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -8.52 23.82 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.676 2.251 . . . . 64.35 112.313 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.34 -15.33 24.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 71.53 111.128 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -76.16 -52.04 10.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 74.11 110.878 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -96.21 23.46 6.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 75.3 110.894 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -87.58 -18.02 30.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 53.01 111.08 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.0 p -89.96 -23.79 21.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 74.43 110.853 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 8.2 p -53.32 139.17 11.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.129 -0.487 . . . . 74.53 111.097 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -94.32 91.38 6.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 74.42 110.893 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -51.3 -30.23 17.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.178 -0.465 . . . . 74.32 111.127 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -58.95 -48.1 82.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 71.41 110.927 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -64.03 111.08 2.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.138 -0.483 . . . . 62.34 110.851 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.59 -24.76 34.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 74.43 110.874 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -66.79 -55.25 15.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.461 . . . . 65.24 110.907 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -58.77 -58.32 9.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.129 -0.487 . . . . 74.11 110.909 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 1.8 p -51.45 -31.46 12.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 75.4 111.091 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.7 mtm -68.49 -51.58 41.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 73.23 110.879 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 32.8 mttt -56.36 -43.77 79.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.466 . . . . 75.12 110.9 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.7 mp -63.62 -56.05 19.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 74.13 111.116 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 85.2 mt -55.88 -37.16 46.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.465 . . . . 75.44 111.145 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -71.23 -51.99 21.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 72.54 110.829 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -58.5 -51.21 70.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 63.42 110.906 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -67.8 -14.77 63.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 72.5 110.883 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.5 mmtt 61.09 52.83 3.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.095 -0.502 . . . . 75.22 110.931 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 37.3 mt -81.5 131.9 56.92 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.637 0.732 . . . . 75.32 111.103 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 153.45 68.74 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.659 2.24 . . . . 74.05 112.331 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.63 165.96 13.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 73.24 111.139 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 86.1 t -51.24 -58.09 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 72.14 111.149 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -50.81 -51.2 53.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.176 -0.465 . . . . 74.33 110.892 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 55.5 mm-40 -57.12 -41.6 79.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.479 . . . . 74.11 110.918 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 29.3 t90 -65.37 -36.96 85.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.201 -0.454 . . . . 75.31 110.936 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.3 mmpp? -65.75 -50.08 66.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 74.31 110.875 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.62 -44.86 96.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 75.11 110.844 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 40.5 mm-40 -60.22 -47.56 85.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 74.42 110.914 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 26.4 p . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.192 -0.458 . . . . 74.31 111.122 -179.892 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.839 0.352 . . . . 74.33 110.94 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 24.3 mm 51.07 74.29 0.83 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.633 0.73 . . . . 75.14 111.115 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 127.98 15.35 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.655 2.237 . . . . 65.34 112.322 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.89 12.11 9.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 73.23 110.86 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.69 162.43 0.74 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.595 0.712 . . . . 74.1 110.866 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -11.34 30.66 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.69 2.26 . . . . 71.35 112.369 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 57.79 80.93 0.26 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.59 0.709 . . . . 74.3 111.08 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 144.04 52.64 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.703 2.269 . . . . 73.02 112.326 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 38.8 mtmt -80.29 160.87 66.94 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.544 0.687 . . . . 73.41 110.906 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 165.68 30.1 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.666 2.244 . . . . 73.14 112.344 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 C--N 1.341 0.174 0 C-N-CA 122.708 2.272 . . . . 60.42 112.309 179.96 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.867 0.365 . . . . 75.51 110.919 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -137.92 139.89 40.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 75.13 110.879 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -130.34 157.99 41.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.135 -0.484 . . . . 62.41 111.133 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.5 p -124.13 128.5 74.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 71.0 111.149 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.48 127.43 32.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 73.24 111.133 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.3 mt -101.21 -18.66 16.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.204 -0.453 . . . . 63.33 110.913 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -133.78 161.56 34.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 74.52 110.898 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -82.02 105.49 13.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 71.44 110.876 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -87.28 125.46 34.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 72.51 110.879 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.43 104.39 14.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 74.43 110.874 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.53 160.37 1.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 64.24 111.094 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -118.47 -32.22 4.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 74.5 110.879 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -124.09 -175.79 3.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 71.25 110.821 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -67.07 -38.93 86.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.459 . . . . 64.12 110.852 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -59.65 -53.1 61.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.231 -0.44 . . . . 75.24 110.844 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -54.24 164.65 0.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.218 -0.446 . . . . 74.33 110.862 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.5 tp -139.46 142.8 37.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.489 . . . . 73.44 110.868 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -86.6 143.09 27.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.466 . . . . 73.34 110.848 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.7 p -153.11 144.03 14.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.226 -0.443 . . . . 74.25 111.109 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.4 m -102.32 160.33 26.67 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.637 0.732 . . . . 72.53 110.873 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 126.38 13.26 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.652 2.235 . . . . 74.51 112.332 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.0 -0.21 31.64 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.737 -0.744 . . . . 74.53 112.508 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -92.11 170.37 9.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.86 0.362 . . . . 74.5 110.86 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -116.26 130.06 56.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 74.3 110.852 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.1 mp -125.09 144.79 50.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.17 -0.468 . . . . 74.33 110.927 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -97.31 112.66 24.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 72.31 110.842 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 58.8 mt -78.86 141.52 15.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 74.23 111.108 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 55.3 m -119.33 -48.81 2.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 73.24 110.861 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -146.09 172.68 13.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 74.54 111.084 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -128.06 178.25 6.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.242 -0.435 . . . . 72.23 110.829 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -138.77 99.88 3.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 75.15 110.933 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.1 t70 54.26 26.35 6.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.135 -0.484 . . . . 60.21 110.839 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 63.08 25.37 14.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.204 -0.453 . . . . 73.22 110.933 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -114.11 -50.01 2.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 74.44 110.858 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.9 m95 -111.42 143.97 41.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.167 -0.47 . . . . 75.33 110.9 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -119.69 133.5 55.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.442 . . . . 74.41 110.918 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.8 mm -88.79 95.23 5.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 72.31 111.145 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -110.6 142.7 42.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.205 -0.452 . . . . 75.33 111.105 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.52 153.63 46.65 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.558 0.694 . . . . 72.13 110.889 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 105.89 1.57 Allowed 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.683 2.255 . . . . 64.05 112.369 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.7 mt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.242 -0.435 . . . . 75.13 111.107 179.976 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo . . . . . 0 N--CA 1.466 -0.141 0 CA-C-O 120.83 0.263 . . . . 74.31 112.325 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -127.7 -137.1 4.39 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.754 -0.736 . . . . 55.14 112.468 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 tt -149.55 125.84 10.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.861 0.362 . . . . 73.24 110.908 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 12.4 p -136.58 132.7 18.77 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.622 0.725 . . . . 64.52 111.096 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 151.53 68.97 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.707 2.272 . . . . 64.43 112.287 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 14.2 t -62.9 -21.9 29.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.232 -0.44 . . . . 73.13 111.155 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.1 m -78.4 -2.4 38.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 64.21 110.877 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -125.07 17.58 8.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 74.22 110.907 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.2 m -153.56 153.1 9.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 73.14 111.127 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 18.5 ttm180 -123.75 119.84 30.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.151 -0.477 . . . . 72.02 110.915 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 16.1 mm -67.19 113.81 3.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 75.55 111.168 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.2 pt -135.33 139.07 47.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 70.03 111.126 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -75.27 122.07 23.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 74.25 110.878 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.98 -31.7 30.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.213 -0.449 . . . . 74.4 110.876 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -85.56 -28.52 24.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 74.04 110.869 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -143.96 77.53 14.61 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.638 0.732 . . . . 64.14 110.896 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 -8.17 22.92 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.675 2.25 . . . . 75.12 112.367 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.91 -5.69 44.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 70.13 111.125 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -84.04 -51.75 6.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 73.34 110.904 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -99.87 23.62 9.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 74.21 110.931 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -83.37 -15.93 47.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.122 -0.49 . . . . 70.32 111.112 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 8.9 m -98.14 -18.74 18.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.44 110.894 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 9.3 p -51.14 150.22 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.092 -0.504 . . . . 74.1 111.129 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -104.76 88.5 2.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 74.12 110.84 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.89 -43.22 63.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.219 -0.446 . . . . 71.45 111.089 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -53.67 -43.89 69.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.282 -0.417 . . . . 74.11 110.92 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -63.92 110.15 2.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 71.11 110.864 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.23 -26.33 28.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 75.04 110.857 -179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -67.11 -56.07 11.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 71.01 110.893 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -59.2 -56.65 19.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.479 . . . . 75.51 110.902 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 2.8 p -52.48 -32.38 16.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.199 -0.455 . . . . 61.44 111.168 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 14.2 mtm -67.73 -55.0 14.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 75.52 110.879 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.5 mttt -54.34 -38.51 66.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 75.51 110.928 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 88.6 mt -66.05 -54.64 24.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.225 -0.443 . . . . 75.0 111.149 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 95.1 mt -60.37 -33.88 55.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 73.33 111.163 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -71.07 -51.84 22.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.176 -0.466 . . . . 55.01 110.83 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -60.49 -43.09 97.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 72.41 110.915 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -76.13 -17.78 59.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 74.42 110.847 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 33.5 mmtm 61.36 52.53 3.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.178 -0.464 . . . . 71.41 110.891 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 21.2 mt -78.4 131.09 69.59 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.639 0.733 . . . . 74.33 111.116 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 158.87 55.5 Favored 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.753 2.302 . . . . 74.42 112.297 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.41 163.25 16.86 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.183 -0.462 . . . . 73.04 111.147 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.2 t -51.01 -58.02 2.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 74.42 111.169 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -50.85 -46.8 60.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 70.15 110.873 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -59.4 -42.2 91.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 75.13 110.915 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 12.2 t90 -64.96 -41.55 95.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 75.25 110.912 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.3 mmtp -62.6 -44.67 95.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.248 -0.433 . . . . 72.21 110.903 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -64.3 -46.67 82.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.258 -0.428 . . . . 74.22 110.873 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -57.73 -53.72 55.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 73.54 110.927 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 4.6 p . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.204 -0.453 . . . . 74.13 111.081 -179.915 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.867 0.365 . . . . 74.05 110.865 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 22.2 mm 51.94 77.6 0.45 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.596 0.713 . . . . 64.35 111.106 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 92.64 0.51 Allowed 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.712 2.275 . . . . 70.51 112.324 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.09 28.53 3.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.269 -0.423 . . . . 64.52 110.884 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' -3' ' ' ARG . . . . . 0.46 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 0.5 OUTLIER -89.64 159.09 44.43 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.58 0.705 . . . . 75.51 110.883 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' -2' ' ' PRO . . . . . 0.46 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 54.1 Cg_endo -69.78 112.41 3.08 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.669 2.246 . . . . 74.34 112.356 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -51.22 108.99 1.18 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.641 0.734 . . . . 73.42 111.087 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 147.14 61.98 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.647 2.231 . . . . 71.31 112.373 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 60.5 mttt -97.6 160.77 27.88 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.592 0.711 . . . . 74.01 110.868 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 167.85 23.28 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.654 2.236 . . . . 74.21 112.372 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.231 0.163 0 C-N-CA 122.666 2.244 . . . . 75.03 112.372 179.992 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.816 0.341 . . . . 75.41 110.962 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -124.48 143.14 50.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 73.43 110.849 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -120.88 151.98 39.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 73.41 111.088 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.2 p -120.17 122.19 67.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.196 -0.457 . . . . 73.22 111.112 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.24 144.53 50.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 52.05 111.118 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 23.3 mt -117.48 -12.17 10.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 64.42 110.873 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -134.67 164.75 26.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.238 -0.437 . . . . 65.02 110.94 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -89.97 105.27 17.7 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.133 -0.485 . . . . 75.31 110.859 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -87.3 123.47 32.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.149 -0.478 . . . . 71.4 110.861 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.84 96.88 7.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.176 -0.466 . . . . 75.4 110.905 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.13 157.69 1.75 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.245 -0.434 . . . . 71.43 111.118 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -116.26 -30.6 5.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.21 -0.45 . . . . 72.24 110.876 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.5 mmm180 -136.2 -177.11 4.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 74.32 110.869 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -60.39 -41.2 93.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.156 -0.475 . . . . 64.44 110.873 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -56.93 -39.85 75.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.145 -0.479 . . . . 74.33 110.864 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -79.87 143.03 34.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.206 -0.452 . . . . 70.04 110.913 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.8 tp -119.89 127.8 53.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.145 -0.479 . . . . 64.43 110.869 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -72.94 139.77 46.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.209 -0.451 . . . . 65.44 110.852 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.2 p -147.14 151.75 13.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.465 . . . . 72.21 111.134 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.5 m -110.23 159.91 30.27 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.657 0.741 . . . . 73.14 110.853 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 120.15 6.98 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.644 2.229 . . . . 71.22 112.357 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.08 3.64 31.46 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.76 -0.733 . . . . 53.13 112.496 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -91.97 149.47 21.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.881 0.372 . . . . 65.3 110.88 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -93.79 139.86 30.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 75.41 110.926 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.4 mp -141.23 145.4 35.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 74.23 110.903 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.1 113.9 26.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.444 . . . . 64.35 110.877 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 43.5 mt -77.22 149.76 6.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.153 -0.476 . . . . 73.32 111.138 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 21.3 m -123.55 -35.91 2.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 71.42 110.863 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -166.52 173.62 9.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.182 -0.463 . . . . 63.22 111.085 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -124.11 176.28 6.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 71.23 110.848 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -137.76 99.56 3.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 75.42 110.887 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.3 t70 55.07 24.92 6.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.105 -0.498 . . . . 74.5 110.895 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 64.08 15.69 9.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 63.54 110.95 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -103.34 -50.65 3.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.125 -0.489 . . . . 72.55 110.858 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 83.0 m95 -111.5 162.86 14.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.146 -0.479 . . . . 75.24 110.964 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -135.93 146.24 47.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.263 -0.426 . . . . 75.43 110.896 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 11.6 mm -104.12 95.23 3.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.142 -0.481 . . . . 73.04 111.122 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -116.42 145.07 43.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.15 -0.477 . . . . 60.41 111.075 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.0 ptpp? -116.14 157.46 45.12 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.59 0.709 . . . . 74.34 110.872 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 131.5 21.46 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.713 2.276 . . . . 55.12 112.339 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 40.5 mt . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.213 -0.449 . . . . 74.23 111.116 179.929 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 N--CA 1.466 -0.118 0 CA-C-O 120.821 0.259 . . . . 62.21 112.323 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -119.57 -153.52 9.3 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.766 -0.73 . . . . 52.43 112.52 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -130.32 129.33 43.06 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.856 0.36 . . . . 75.23 110.91 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.5 p -141.15 132.04 13.42 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.668 0.746 . . . . 71.15 111.098 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.74 165.51 30.69 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.662 2.241 . . . . 73.41 112.363 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 15.3 t -74.1 -21.24 17.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.24 -0.437 . . . . 61.42 111.154 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 56.4 m -81.3 1.8 30.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.17 -0.468 . . . . 75.44 110.832 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -129.26 22.75 5.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 75.54 110.911 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 27.5 m -151.3 146.41 16.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 75.11 111.096 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 33.3 ttp85 -115.64 111.66 20.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 65.54 110.912 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.4 mm -66.05 118.55 9.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.207 -0.451 . . . . 74.33 111.074 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 15.3 pt -136.1 165.89 28.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 64.11 111.147 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -109.21 127.31 54.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 70.32 110.867 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.9 mt -55.48 -29.59 59.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 73.51 110.889 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.58 -20.19 28.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 74.03 110.935 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -161.45 82.1 1.93 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.648 0.737 . . . . 75.44 110.819 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -8.52 23.81 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.717 2.278 . . . . 72.34 112.351 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.79 0.25 56.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 75.1 111.109 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -84.31 -47.15 11.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 74.42 110.889 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -110.98 23.71 13.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 74.42 110.914 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.07 -20.82 51.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 72.21 111.077 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 80.9 p -104.59 -8.42 18.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.428 . . . . 71.23 110.846 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 9.8 p -51.37 157.84 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 71.44 111.123 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -104.09 82.46 1.97 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.138 -0.483 . . . . 72.3 110.871 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.29 -44.64 72.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.448 . . . . 74.14 111.093 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -55.28 -40.92 71.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.239 -0.437 . . . . 63.11 110.948 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -63.96 108.42 1.49 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.103 -0.499 . . . . 73.23 110.852 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -51.97 -29.3 19.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.455 . . . . 61.31 110.876 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -66.98 -56.42 10.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 73.4 110.869 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -59.23 -54.9 41.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.461 . . . . 72.22 110.936 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 4.8 p -54.27 -32.68 24.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 74.24 111.121 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.4 mtm -67.37 -56.04 11.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.474 . . . . 73.32 110.817 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -54.62 -37.51 65.71 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.247 -0.433 . . . . 74.44 110.911 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 27.9 mt -66.22 -55.1 20.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 74.43 111.14 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 96.4 mt -60.51 -36.73 71.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.153 -0.476 . . . . 70.43 111.149 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -70.93 -46.73 61.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.156 -0.475 . . . . 75.33 110.857 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -64.42 -47.1 80.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 75.32 110.853 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -72.34 -12.84 61.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 75.41 110.898 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.56 53.06 6.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.137 -0.483 . . . . 75.31 110.881 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 59.0 mt -83.73 132.94 47.44 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.64 0.733 . . . . 75.41 111.105 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 163.83 36.81 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.705 2.27 . . . . 75.25 112.324 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.28 169.2 9.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.173 -0.467 . . . . 74.13 111.135 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 91.7 t -51.43 -56.53 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 71.51 111.131 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -52.43 -52.13 55.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 75.45 110.857 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 57.7 mm-40 -56.86 -42.68 80.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 73.43 110.886 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 33.4 t90 -66.1 -36.93 84.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 75.21 110.898 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -68.43 -35.03 77.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 74.42 110.892 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -72.16 -49.46 35.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 63.14 110.834 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -61.56 -39.94 92.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 71.54 110.905 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 38.1 p . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 75.13 111.153 -179.92 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.838 0.351 . . . . 75.11 110.868 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.0 mm 51.83 81.0 0.27 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.607 0.718 . . . . 74.51 111.092 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 81.43 0.82 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.671 2.247 . . . . 73.33 112.309 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 5.4 t -97.21 37.27 1.35 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 72.1 110.861 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' -3' ' ' ARG . . . . . 0.411 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 5.6 mmm180 -98.16 160.56 27.98 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.596 0.713 . . . . 74.14 110.879 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' -2' ' ' PRO . . . . . 0.411 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.6 Cg_endo -69.79 99.53 0.76 Allowed 'Trans proline' 0 C--N 1.34 0.13 0 C-N-CA 122.657 2.238 . . . . 74.44 112.31 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -51.13 108.96 1.17 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.542 0.687 . . . . 72.14 111.094 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 154.25 67.98 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.704 2.269 . . . . 74.51 112.334 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 12.7 mtpp -99.56 160.66 26.83 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.539 0.685 . . . . 74.44 110.87 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 167.82 23.32 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.693 2.262 . . . . 74.55 112.335 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--N 1.341 0.149 0 C-N-CA 122.683 2.255 . . . . 65.31 112.359 179.933 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.826 0.346 . . . . 55.25 110.923 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -128.55 139.55 52.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.466 . . . . 73.4 110.866 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.93 159.55 40.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.49 . . . . 71.4 111.111 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.6 p -124.75 127.05 72.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 75.52 111.11 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.04 126.95 30.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.209 -0.451 . . . . 62.21 111.106 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 66.1 mt -101.73 -17.68 16.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 60.31 110.906 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -132.87 160.82 35.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 72.3 110.889 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -86.42 105.08 16.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.084 -0.507 . . . . 72.4 110.852 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -84.81 126.17 33.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 74.22 110.894 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.4 mttm -101.91 100.17 10.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.119 -0.491 . . . . 75.53 110.905 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.74 149.68 5.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 70.3 111.091 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -123.05 -36.34 2.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 73.02 110.884 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.9 mmt180 -114.56 -178.19 3.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 75.14 110.861 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -68.36 -35.68 78.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 73.31 110.865 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -67.96 -41.17 82.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.242 -0.436 . . . . 61.25 110.858 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.15 166.77 3.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 72.34 110.904 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.2 tp -142.37 149.96 40.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 75.12 110.948 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -94.67 131.46 40.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 71.53 110.867 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.8 p -148.59 149.49 15.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 72.44 111.101 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.9 m -110.67 160.43 28.7 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.646 0.736 . . . . 74.44 110.859 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 128.2 15.67 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.71 2.273 . . . . 72.22 112.334 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.09 -6.02 32.28 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.709 -0.758 . . . . 54.12 112.509 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -92.2 155.18 18.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.852 0.358 . . . . 73.42 110.871 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -96.14 139.25 32.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.03 110.917 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -131.57 142.01 49.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.18 -0.464 . . . . 72.13 110.886 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.82 116.78 33.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.209 -0.45 . . . . 61.53 110.842 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 26.4 mt -84.08 146.01 7.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.106 -0.497 . . . . 72.21 111.115 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 22.9 m -118.53 -27.76 5.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 74.42 110.828 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -169.67 178.48 4.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.45 . . . . 65.53 111.128 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -129.47 176.59 7.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.254 -0.43 . . . . 72.32 110.862 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -137.89 99.4 3.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 74.1 110.857 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 46.6 t0 54.31 25.69 6.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 72.45 110.831 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 63.26 23.1 13.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.194 -0.457 . . . . 71.01 110.958 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -111.79 -53.3 2.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.505 . . . . 73.33 110.899 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 79.9 m95 -109.13 144.26 37.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.152 -0.477 . . . . 74.55 110.929 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -117.59 130.09 56.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.435 . . . . 75.41 110.873 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.1 mm -87.9 95.11 4.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.119 -0.491 . . . . 72.21 111.153 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -110.09 157.75 19.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 65.21 111.066 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -132.33 157.94 76.93 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.558 0.694 . . . . 74.12 110.872 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 115.15 3.95 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.679 2.253 . . . . 75.23 112.324 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.8 mt . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.469 . . . . 75.41 111.145 179.887 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 N--CA 1.466 -0.124 0 CA-C-O 120.801 0.25 . . . . 71.25 112.353 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -128.17 -144.97 5.96 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.746 -0.74 . . . . 60.23 112.514 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -147.98 129.87 15.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.869 0.366 . . . . 72.34 110.867 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.0 p -142.36 132.83 12.59 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.634 0.731 . . . . 75.03 111.101 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 152.27 69.18 Favored 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.656 2.238 . . . . 74.15 112.355 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 13.7 t -62.52 -22.31 29.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.225 -0.443 . . . . 73.23 111.146 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.9 t -78.04 -3.18 40.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.144 -0.48 . . . . 72.35 110.889 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -123.57 18.05 9.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 64.35 110.938 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.8 m -153.95 149.41 12.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.093 -0.503 . . . . 72.33 111.142 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.4 ttm180 -116.41 118.12 31.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.47 . . . . 75.04 110.897 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 24.3 mm -70.12 116.47 11.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 75.4 111.132 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 11.3 pt -134.71 172.02 16.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.479 . . . . 73.04 111.122 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -115.06 147.17 40.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.171 -0.468 . . . . 55.24 110.85 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.2 mt -72.59 -35.54 67.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.455 . . . . 75.11 110.932 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 21.1 mmt -81.93 -25.21 35.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.142 -0.481 . . . . 73.13 110.865 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -151.94 74.13 7.77 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.605 0.717 . . . . 74.24 110.88 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 -8.62 24.07 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.662 2.241 . . . . 75.24 112.381 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.73 -14.77 25.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.195 -0.457 . . . . 74.4 111.071 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -75.01 -51.96 12.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.273 -0.421 . . . . 75.34 110.913 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -95.4 23.02 6.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 74.23 110.908 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -87.57 -21.17 25.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.118 -0.492 . . . . 72.14 111.113 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.6 t -95.37 -21.12 18.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.439 . . . . 72.54 110.865 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 10.7 p -51.57 149.22 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.116 -0.493 . . . . 72.34 111.133 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -99.32 105.77 17.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 73.13 110.835 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.37 -39.72 81.68 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.146 -0.479 . . . . 75.45 111.115 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 35.2 t80 -54.05 -44.31 70.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 74.35 110.922 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.99 108.94 1.63 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 72.34 110.854 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.6 -25.18 37.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 74.12 110.839 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -66.48 -54.75 20.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.185 -0.462 . . . . 75.45 110.948 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 3.8 mm100 -59.27 -57.09 14.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.079 -0.509 . . . . 64.35 110.943 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -52.66 -31.56 16.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 71.24 111.132 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.9 mtm -68.25 -54.31 18.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.135 -0.484 . . . . 71.44 110.849 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.0 mttm -55.69 -39.95 71.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.43 . . . . 75.21 110.857 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 67.4 mt -64.93 -54.36 30.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 65.34 111.108 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 96.9 mt -59.98 -29.65 43.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 75.55 111.128 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -70.76 -52.7 19.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 75.43 110.855 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.01 -31.37 71.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 72.42 110.898 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -81.32 -6.48 58.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.156 -0.475 . . . . 71.41 110.852 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 50.7 42.81 27.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.163 -0.471 . . . . 72.3 110.923 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.8 mt -81.01 119.06 74.95 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.665 0.745 . . . . 75.32 111.091 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 155.8 64.97 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.699 2.266 . . . . 75.22 112.336 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.19 176.97 9.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.444 . . . . 63.0 111.129 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.8 t -57.67 -53.02 50.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.221 -0.445 . . . . 73.21 111.099 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -51.63 -49.19 62.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 64.53 110.887 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 67.6 mm-40 -58.82 -41.13 86.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 71.35 110.892 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 30.0 t90 -64.68 -42.61 95.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.195 -0.457 . . . . 74.31 110.911 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -61.98 -50.42 72.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.451 . . . . 75.24 110.915 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -61.43 -41.35 97.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 75.21 110.86 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -59.88 -51.07 71.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 74.41 110.855 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.1 p . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.24 -0.436 . . . . 74.33 111.13 -179.883 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.804 0.335 . . . . 64.11 110.832 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 23.8 mm 51.31 77.97 0.43 Allowed Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.632 0.729 . . . . 72.41 111.131 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 90.96 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.66 2.24 . . . . 62.03 112.32 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 16.3 t -102.79 34.56 2.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 72.02 110.853 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 3.3 mtp85 -95.31 160.3 30.97 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.554 0.693 . . . . 74.45 110.93 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 102.51 1.04 Allowed 'Trans proline' 0 N--CA 1.466 -0.145 0 C-N-CA 122.718 2.279 . . . . 74.24 112.381 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -51.05 108.9 1.15 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.615 0.721 . . . . 73.3 111.139 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.71 150.94 69.18 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.745 2.297 . . . . 71.43 112.301 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -97.95 160.87 27.38 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.53 0.681 . . . . 73.12 110.92 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.76 167.88 23.16 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.649 2.232 . . . . 74.31 112.368 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--N 1.342 0.186 0 C-N-CA 122.61 2.207 . . . . 73.52 112.373 179.938 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.838 0.351 . . . . 71.21 110.889 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -134.65 140.01 45.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 74.32 110.902 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -111.24 169.76 8.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.485 . . . . 71.41 111.063 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.6 p -136.94 124.93 33.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.459 . . . . 73.31 111.1 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.07 147.48 44.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 74.44 111.161 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 18.0 mt -118.14 -11.82 10.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.234 -0.439 . . . . 73.14 110.909 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -140.18 166.91 23.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 74.34 110.967 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -89.88 110.04 21.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 72.34 110.896 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -91.43 116.15 28.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 75.54 110.887 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.56 108.44 19.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.497 . . . . 72.14 110.878 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.27 158.98 15.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 75.25 111.09 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -124.68 -37.14 2.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.256 -0.429 . . . . 63.11 110.872 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.8 mmt180 -122.29 167.16 13.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.475 . . . . 75.5 110.875 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -53.63 -40.76 66.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 65.32 110.887 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -65.04 -25.35 67.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.254 -0.43 . . . . 75.32 110.858 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -90.29 129.07 36.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 72.41 110.909 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.8 tp -108.29 145.07 34.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 65.11 110.879 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -89.09 150.26 22.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 75.32 110.876 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 8.8 p -147.43 156.16 10.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 74.23 111.136 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 14.1 p -111.02 154.51 43.41 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.638 0.732 . . . . 74.11 110.879 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 128.17 15.66 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.691 2.261 . . . . 74.25 112.402 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.8 -2.93 60.48 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.794 -0.717 . . . . 63.03 112.521 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -85.6 158.41 20.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.846 0.355 . . . . 74.13 110.901 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -101.39 131.95 47.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 74.34 110.903 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -123.66 159.97 28.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.161 -0.472 . . . . 74.14 110.918 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.81 112.88 25.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.446 . . . . 72.31 110.89 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 38.2 mm -70.88 143.27 14.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.126 -0.488 . . . . 74.21 111.169 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.2 m -122.92 -35.83 2.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 72.3 110.861 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -170.78 173.4 5.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 74.14 111.118 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -128.12 176.18 7.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 74.14 110.859 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -137.78 99.86 4.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 73.21 110.902 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.5 t0 54.4 25.75 6.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.119 -0.491 . . . . 73.44 110.798 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 63.27 26.34 15.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.224 -0.443 . . . . 74.43 110.911 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -115.64 -46.56 2.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.103 -0.499 . . . . 74.14 110.882 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -114.73 146.95 40.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.177 -0.465 . . . . 75.5 110.894 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -123.82 143.66 50.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 71.41 110.902 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.6 mm -101.22 98.49 6.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 74.32 111.131 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -110.86 138.36 47.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.155 -0.475 . . . . 62.42 111.131 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -112.59 157.56 39.94 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.571 0.7 . . . . 72.3 110.906 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 131.24 20.87 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.659 2.239 . . . . 75.31 112.388 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 35.9 mt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.227 -0.442 . . . . 75.54 111.134 179.936 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.23 0.122 0 CA-C-O 120.843 0.268 . . . . 73.14 112.312 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -117.68 -166.87 14.07 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.776 -0.726 . . . . 54.4 112.541 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.9 124.83 45.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.897 0.38 . . . . 65.03 110.857 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.2 p -134.94 133.13 20.75 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.635 0.731 . . . . 71.21 111.132 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 153.87 68.44 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.721 2.281 . . . . 75.54 112.332 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 11.8 t -65.55 -21.65 29.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.204 -0.453 . . . . 73.44 111.151 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 7.1 m -78.57 -1.86 36.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 62.14 110.8 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -121.38 2.18 10.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.185 -0.461 . . . . 71.13 110.921 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.0 m -139.45 160.16 28.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.493 . . . . 70.01 111.111 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -127.26 123.64 36.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.167 -0.47 . . . . 74.23 110.862 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 24.8 mm -74.39 110.29 8.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.471 . . . . 63.22 111.129 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 6.7 pt -124.27 -177.87 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.155 -0.475 . . . . 75.32 111.138 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -128.64 145.9 51.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 73.14 110.908 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.5 mp -73.29 -38.3 65.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 74.02 110.926 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.83 -24.12 52.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 72.54 110.912 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -155.31 75.96 5.16 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.626 0.727 . . . . 73.44 110.856 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 -8.32 23.31 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.663 2.242 . . . . 64.33 112.367 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.81 -15.36 23.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.447 . . . . 72.05 111.085 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -77.73 -51.66 10.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.252 -0.431 . . . . 72.03 110.914 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -95.35 23.15 6.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.255 -0.429 . . . . 74.45 110.915 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -88.03 -23.81 23.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.095 -0.502 . . . . 70.21 111.1 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 13.0 p -91.68 -9.72 42.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 71.54 110.835 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 55.2 t -51.49 139.94 6.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.14 -0.482 . . . . 73.22 111.101 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -94.77 75.42 3.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.476 . . . . 74.45 110.867 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -46.92 -34.58 5.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 65.43 111.127 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -57.94 -45.19 86.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 74.53 110.903 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -69.67 114.82 8.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 74.53 110.903 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.08 -23.98 37.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.214 -0.448 . . . . 74.02 110.858 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -66.81 -57.68 6.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 74.21 110.843 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -57.64 -57.59 12.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 73.11 110.944 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.7 p -51.43 -32.12 12.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 74.53 111.162 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.7 mtm -68.17 -51.64 43.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.476 . . . . 75.23 110.852 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.9 mttm -55.83 -42.67 76.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 74.02 110.904 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.6 mp -64.79 -55.04 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 53.03 111.149 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 90.5 mt -57.7 -37.53 59.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 74.34 111.087 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -71.08 -52.02 21.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 73.42 110.896 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -58.94 -51.35 70.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 65.34 110.844 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -68.66 -14.1 62.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.145 -0.479 . . . . 71.53 110.883 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? 58.76 54.23 5.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 74.51 110.914 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 22.6 mt -81.74 131.19 58.3 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.655 0.74 . . . . 75.24 111.134 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 158.23 57.66 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.685 2.257 . . . . 74.5 112.363 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -85.37 169.94 13.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 74.2 111.164 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 25.4 t -51.51 -52.04 22.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 71.33 111.116 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -59.87 -47.48 85.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 60.24 110.891 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -57.48 -27.84 62.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.127 -0.488 . . . . 74.54 110.94 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -73.27 -48.01 38.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 73.52 110.94 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 11.6 mtmt -64.86 -39.97 94.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.219 -0.446 . . . . 75.13 110.905 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -70.23 -43.51 70.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.464 . . . . 72.32 110.867 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 39.7 mm-40 -61.37 -45.96 92.19 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.18 -0.464 . . . . 72.11 110.917 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.3 p . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 74.4 111.141 -179.94 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.803 0.335 . . . . 73.25 110.837 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 27.9 mm 51.39 76.21 0.57 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.573 0.701 . . . . 72.2 111.153 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 104.58 1.34 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.693 2.262 . . . . 75.44 112.354 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 31.0 t -96.47 5.08 51.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 54.41 110.829 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -51.68 162.15 0.78 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.637 0.732 . . . . 74.32 110.891 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -19.09 36.76 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.669 2.246 . . . . 74.11 112.357 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 63.69 82.6 0.21 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.628 0.728 . . . . 74.43 111.117 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 140.75 43.47 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.681 2.254 . . . . 53.11 112.349 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 26.3 mtmm -72.14 160.72 81.95 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.582 0.706 . . . . 75.11 110.889 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 167.75 23.54 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.704 2.269 . . . . 74.32 112.329 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 C--N 1.342 0.208 0 C-N-CA 122.638 2.226 . . . . 65.45 112.367 179.919 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.5 pp . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.858 0.361 . . . . 73.23 110.885 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -128.97 148.17 50.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 73.41 110.902 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -122.7 168.6 12.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.137 -0.483 . . . . 73.25 111.09 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.4 p -134.27 130.17 54.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 75.13 111.127 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.74 142.47 48.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 73.43 111.143 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.7 mt -117.6 -17.1 10.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.452 . . . . 73.22 110.91 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -129.29 167.95 16.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.178 -0.465 . . . . 74.14 110.949 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -92.14 112.19 24.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.119 -0.491 . . . . 74.24 110.868 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -92.17 123.16 35.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.129 -0.487 . . . . 72.01 110.92 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.9 mttt -101.96 101.01 11.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 75.23 110.958 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.17 155.65 20.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.439 . . . . 72.3 111.109 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -122.72 -35.99 2.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 75.22 110.841 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -121.67 -176.49 3.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.156 -0.475 . . . . 73.13 110.844 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -68.23 -38.45 81.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 65.11 110.855 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -63.7 -32.95 74.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 73.44 110.846 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -79.3 147.71 32.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.436 . . . . 75.34 110.846 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.7 tp -127.5 121.6 31.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.113 -0.494 . . . . 74.14 110.909 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -77.32 144.07 38.32 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.236 -0.438 . . . . 72.22 110.882 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.0 p -149.89 154.71 8.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 72.53 111.176 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.0 m -105.84 156.14 37.11 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.715 0.769 . . . . 74.44 110.864 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.86 139.88 40.96 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.703 2.269 . . . . 74.21 112.341 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.35 -4.99 74.32 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.741 -0.742 . . . . 64.04 112.461 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -89.54 146.08 24.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.868 0.366 . . . . 74.34 110.918 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -89.76 123.7 33.99 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 65.41 110.884 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -116.08 145.64 42.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 73.42 110.877 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.2 t -101.24 112.89 25.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.154 -0.475 . . . . 53.33 110.862 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 56.6 mt -78.36 144.57 11.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.099 -0.5 . . . . 74.42 111.141 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.2 m -117.95 -41.94 2.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.18 -0.464 . . . . 73.4 110.837 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.37 175.35 14.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 64.51 111.081 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -127.22 178.52 5.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 75.44 110.838 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -150.88 107.22 3.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.212 -0.449 . . . . 74.43 110.951 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 57.62 20.07 5.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.143 -0.481 . . . . 73.41 110.906 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 58.84 21.88 9.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 72.33 110.912 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -118.17 -24.81 6.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 74.32 110.866 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -130.23 135.87 48.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 74.01 110.903 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -118.56 138.79 52.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.254 -0.43 . . . . 74.44 110.859 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.2 mm -93.77 94.17 4.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 71.45 111.119 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -109.97 149.64 29.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 75.53 111.11 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.2 pttp -124.9 158.01 64.42 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.576 0.703 . . . . 75.12 110.913 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 153.94 68.29 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.671 2.248 . . . . 73.11 112.343 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 29.0 mt . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 72.12 111.118 179.931 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 N--CA 1.465 -0.16 0 CA-C-O 120.794 0.248 . . . . 74.32 112.351 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -121.79 163.69 15.15 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.697 -0.763 . . . . 72.24 112.476 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -108.89 124.68 51.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.853 0.359 . . . . 73.3 110.933 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.2 p -143.3 133.21 11.94 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.665 0.745 . . . . 71.02 111.119 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.76 152.42 69.29 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.707 2.271 . . . . 75.35 112.284 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 12.4 t -64.92 -20.75 28.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 64.24 111.132 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.6 m -79.56 0.41 29.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 74.41 110.837 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -127.63 18.61 6.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 72.2 110.926 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.5 m -151.9 160.29 3.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.097 -0.501 . . . . 74.43 111.109 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ttp180 -123.62 129.43 51.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 74.15 110.885 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 44.6 mm -81.89 111.95 19.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 72.43 111.169 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.6 pt -129.98 -178.28 2.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 70.21 111.125 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -129.15 129.63 45.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.189 -0.46 . . . . 75.31 110.85 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.4 mt -55.19 -26.2 37.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 73.4 110.89 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.51 -30.77 16.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 73.15 110.873 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -141.05 73.92 26.03 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.578 0.704 . . . . 75.45 110.862 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 -13.77 35.02 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.66 2.24 . . . . 75.11 112.312 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.99 -16.14 20.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.237 -0.438 . . . . 64.03 111.122 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.9 ttmt -74.26 -52.17 13.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 75.13 110.89 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -95.41 23.17 6.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.195 -0.457 . . . . 73.01 110.931 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -87.0 -18.76 29.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 73.55 111.068 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.3 p -95.93 -21.22 18.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.24 -0.436 . . . . 74.53 110.825 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 9.6 p -51.45 145.54 2.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.138 -0.483 . . . . 73.22 111.107 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.44 106.43 18.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.173 -0.467 . . . . 72.04 110.852 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.59 -35.79 73.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 74.45 111.097 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -60.66 -41.52 95.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.186 -0.461 . . . . 70.42 110.928 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 57.4 t0 -63.94 107.85 1.34 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.138 -0.483 . . . . 74.52 110.854 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.15 -27.08 31.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 73.11 110.868 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -67.15 -55.26 14.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 73.44 110.912 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -59.71 -56.58 20.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 73.12 110.879 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 2.4 p -52.81 -31.7 16.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 62.33 111.131 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 11.4 mtm -68.02 -56.08 10.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 74.23 110.932 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 41.1 mttm -54.84 -36.96 65.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 75.44 110.919 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 27.0 mt -66.91 -55.18 18.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 72.25 111.116 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 96.9 mt -60.57 -36.05 67.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.461 . . . . 73.14 111.092 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -71.27 -50.17 35.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 74.53 110.864 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -62.82 -47.04 85.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 75.31 110.884 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -70.72 -14.08 62.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 74.33 110.908 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.85 54.94 4.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.483 . . . . 74.44 110.856 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.9 mt -85.12 132.18 46.27 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.602 0.715 . . . . 64.52 111.125 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 161.07 47.36 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.671 2.247 . . . . 72.53 112.361 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.31 165.67 11.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.248 -0.433 . . . . 73.42 111.203 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 87.2 t -50.84 -52.66 16.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.262 -0.427 . . . . 72.13 111.112 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -52.22 -52.17 53.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 75.34 110.931 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -58.04 -42.75 86.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.148 -0.478 . . . . 74.43 110.912 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 55.5 t90 -65.32 -36.26 83.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.219 -0.446 . . . . 73.12 110.94 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? -68.29 -37.82 81.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 72.32 110.907 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -69.81 -50.52 42.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 74.52 110.885 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -59.89 -39.66 86.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 74.35 110.901 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 30.8 p . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 74.24 111.163 -179.911 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.796 0.331 . . . . 73.43 110.896 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 22.1 mm 50.25 78.22 0.41 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.611 0.719 . . . . 74.4 111.14 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 97.09 0.62 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.661 2.241 . . . . 64.44 112.337 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 28.7 t -95.99 3.28 53.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.197 -0.456 . . . . 70.14 110.863 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.54 162.39 0.71 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.637 0.732 . . . . 74.3 110.874 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 -17.94 37.17 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.674 2.249 . . . . 71.52 112.322 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 63.89 84.04 0.19 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.618 0.723 . . . . 70.11 111.097 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 140.01 41.79 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.696 2.264 . . . . 74.13 112.36 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -73.6 160.59 81.87 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.602 0.715 . . . . 73.04 110.909 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 167.1 25.47 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.667 2.245 . . . . 74.22 112.323 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo . . . . . 0 N--CA 1.465 -0.17 0 C-N-CA 122.703 2.269 . . . . 75.52 112.401 179.915 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 pp . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.826 0.346 . . . . 75.32 110.924 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -126.03 156.65 39.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 72.4 110.848 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.43 156.05 48.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 63.0 111.088 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 p -123.36 121.63 63.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 73.44 111.187 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -64.95 140.73 58.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 75.33 111.169 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.2 mt -116.71 -13.87 10.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.262 -0.426 . . . . 73.32 110.923 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -134.98 158.58 43.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.172 -0.467 . . . . 74.01 110.939 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.56 105.22 14.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.117 -0.492 . . . . 72.21 110.897 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -86.64 132.86 33.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.159 -0.473 . . . . 74.43 110.904 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.01 98.61 7.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 64.2 110.873 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.13 159.45 1.25 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.426 . . . . 75.51 111.096 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -116.4 -23.93 8.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 74.45 110.895 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.5 mmm-85 -141.14 -177.51 5.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 74.32 110.86 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -58.18 -46.08 86.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 70.21 110.875 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -52.32 -52.65 51.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 74.25 110.844 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.9 mp0 -67.01 151.16 48.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 52.33 110.872 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.0 tp -125.87 151.71 46.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.155 -0.475 . . . . 75.23 110.886 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -95.13 142.25 27.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 74.33 110.867 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.6 p -152.45 150.14 13.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.18 -0.464 . . . . 74.13 111.128 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.3 m -105.96 159.64 28.94 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.682 0.753 . . . . 73.23 110.84 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.68 121.82 8.52 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.732 2.288 . . . . 70.41 112.363 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.13 1.77 31.58 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.68 -0.771 . . . . 71.11 112.483 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -92.14 156.96 16.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.855 0.359 . . . . 72.01 110.869 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -100.88 131.69 46.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.48 . . . . 72.41 110.921 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.7 mp -130.83 146.27 52.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.207 -0.451 . . . . 73.24 110.896 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.14 115.97 31.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 72.12 110.876 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 43.9 mt -80.8 150.46 4.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 74.52 111.12 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 24.7 m -123.93 -41.7 2.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 55.43 110.868 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -154.63 -178.42 7.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 73.14 111.124 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -134.62 175.25 9.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 73.45 110.858 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -137.39 100.29 4.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.233 -0.44 . . . . 73.54 110.929 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 55.58 25.63 8.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.098 -0.501 . . . . 75.44 110.886 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 63.61 16.4 9.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 73.32 110.935 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -104.03 -54.89 2.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.123 -0.489 . . . . 65.34 110.886 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 39.1 m95 -105.65 151.7 24.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.156 -0.475 . . . . 75.14 110.935 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -124.75 135.89 53.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 72.33 110.874 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.7 mm -93.13 95.98 5.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 74.51 111.136 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -113.79 153.96 28.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 71.1 111.109 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 ptmt -126.73 157.6 70.76 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.568 0.699 . . . . 74.31 110.882 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 130.92 20.22 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.666 2.244 . . . . 75.33 112.346 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 76.9 mt . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.427 . . . . 73.51 111.11 179.925 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo . . . . . 0 C--O 1.23 0.117 0 CA-C-O 120.859 0.275 . . . . 73.23 112.304 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -116.11 -122.46 3.44 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.728 -0.749 . . . . 31.11 112.471 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -153.69 124.79 7.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.837 0.351 . . . . 72.43 110.932 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.0 p -134.87 132.76 20.6 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.646 0.736 . . . . 74.21 111.152 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.7 150.49 68.67 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.711 2.274 . . . . 74.42 112.381 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 52.9 t -58.17 -22.6 19.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 75.51 111.134 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -77.93 -3.89 44.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 74.0 110.829 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -122.25 18.6 10.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.465 . . . . 73.23 110.935 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.8 m -153.92 140.07 11.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 71.32 111.097 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.2 ttm180 -112.87 117.01 30.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 71.52 110.861 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 31.3 mm -66.84 109.18 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.206 -0.452 . . . . 74.5 111.129 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 3.5 pt -130.91 170.09 20.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 74.41 111.18 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -114.41 141.24 47.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.197 -0.456 . . . . 73.12 110.846 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.29 -24.99 66.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 64.24 110.92 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.85 -28.98 17.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 74.13 110.87 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -148.73 73.6 10.47 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.59 0.709 . . . . 73.23 110.839 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 -10.87 29.59 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.709 2.273 . . . . 73.31 112.331 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.69 -12.67 33.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 72.41 111.095 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.6 ttmm -74.44 -52.06 13.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.459 . . . . 75.54 110.905 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -98.38 23.11 8.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 74.53 110.926 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -81.43 -21.97 38.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.108 -0.497 . . . . 65.41 111.08 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.2 t -96.96 -12.68 23.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 65.2 110.829 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 55.4 t -51.44 141.73 4.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 63.1 111.157 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -91.35 76.13 5.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.173 -0.467 . . . . 74.1 110.875 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -47.51 -34.91 8.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.185 -0.462 . . . . 72.14 111.143 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -60.17 -44.24 95.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 71.13 110.953 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -63.87 113.47 3.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.088 -0.506 . . . . 73.44 110.886 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.06 -24.13 37.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 74.1 110.866 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -66.3 -57.4 7.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 72.25 110.895 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -57.61 -56.07 26.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 65.35 110.913 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -53.41 -31.32 18.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 74.21 111.128 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 7.8 mtm -68.35 -55.54 11.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.484 . . . . 74.31 110.863 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 48.2 mttt -54.53 -39.04 67.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.262 -0.426 . . . . 74.13 110.894 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 70.4 mt -65.71 -58.22 7.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 71.33 111.079 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 97.8 mt -57.79 -35.17 50.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 73.42 111.127 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -70.77 -52.01 23.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.153 -0.476 . . . . 65.32 110.836 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -61.28 -49.4 77.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 74.31 110.892 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -68.9 -14.5 63.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 74.51 110.881 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.65 55.57 4.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 72.15 110.902 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 39.0 mt -84.9 132.07 47.11 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 121.671 0.748 . . . . 73.02 111.16 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 151.33 68.78 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.634 2.223 . . . . 74.3 112.389 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -85.55 168.29 14.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.43 . . . . 73.15 111.167 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 71.1 t -51.66 -58.12 2.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 74.03 111.108 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -52.02 -51.65 55.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 75.43 110.874 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 40.1 mm-40 -57.02 -41.07 77.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.156 -0.475 . . . . 74.32 110.878 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 34.8 t90 -66.93 -38.02 85.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.251 -0.431 . . . . 73.22 110.932 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -68.12 -35.47 78.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 74.21 110.926 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -71.79 -49.85 35.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 61.54 110.912 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -61.03 -39.93 91.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 75.54 110.891 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 38.8 p . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 74.31 111.157 -179.95 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.863 0.363 . . . . 72.35 110.863 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 3.0 mp -78.26 116.47 59.28 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.608 0.718 . . . . 75.44 111.141 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 -49.58 0.55 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.679 2.253 . . . . 74.54 112.366 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 1.2 t 49.61 32.36 4.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.46 . . . . 72.31 110.877 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -116.31 162.56 25.69 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.598 0.713 . . . . 74.22 110.872 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.68 -18.19 37.5 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.714 2.276 . . . . 73.11 112.355 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 65.92 146.15 0.1 OUTLIER Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.593 0.711 . . . . 70.13 111.08 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.79 153.49 68.72 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.674 2.249 . . . . 63.31 112.362 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 5.2 mtmp? -100.4 161.17 24.92 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.598 0.713 . . . . 71.34 110.894 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 165.31 31.38 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.664 2.243 . . . . 63.32 112.356 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--N 1.341 0.14 0 C-N-CA 122.678 2.252 . . . . 74.24 112.321 179.972 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.816 0.341 . . . . 75.33 110.939 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -130.15 150.65 51.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 73.34 110.866 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -135.04 144.86 47.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.154 -0.476 . . . . 64.01 111.102 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 10.0 p -114.58 129.38 70.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 75.11 111.131 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.17 132.3 46.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.47 . . . . 74.31 111.119 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.8 mt -100.73 -20.94 15.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 74.22 110.918 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -129.25 168.62 15.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.472 . . . . 71.03 110.942 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -88.91 104.89 17.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.479 . . . . 73.22 110.899 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -91.46 104.42 16.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 72.42 110.886 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.6 mmtp -84.96 106.44 16.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 72.55 110.909 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.24 158.74 3.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.225 -0.443 . . . . 64.21 111.116 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -128.49 -39.2 1.68 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.23 -0.441 . . . . 74.52 110.863 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 16.0 mmm180 -108.28 178.86 4.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 75.22 110.854 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -67.27 -36.38 81.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.193 -0.458 . . . . 71.05 110.833 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -68.76 -49.14 61.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 75.54 110.903 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -57.04 135.45 56.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.22 -0.445 . . . . 70.31 110.88 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.0 tp -112.13 129.77 56.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 73.44 110.91 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.01 142.1 45.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 74.3 110.846 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.4 p -152.82 144.61 15.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.198 -0.456 . . . . 62.22 111.135 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.3 m -105.47 160.52 25.77 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.668 0.746 . . . . 74.34 110.89 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 122.23 8.92 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.694 2.263 . . . . 73.15 112.38 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.09 5.53 30.53 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.765 -0.731 . . . . 70.12 112.473 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -92.3 161.08 14.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.82 0.343 . . . . 74.43 110.91 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -107.83 127.03 53.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.195 -0.457 . . . . 75.22 110.894 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.1 mt -129.7 146.5 51.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 74.42 110.919 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.7 t -104.86 112.54 25.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 61.11 110.887 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 58.1 mt -81.92 145.41 8.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.128 -0.487 . . . . 75.21 111.147 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 80.8 m -117.27 -33.41 4.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 54.43 110.869 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -161.04 173.57 15.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 71.44 111.102 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -122.84 177.95 5.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 73.21 110.845 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -141.94 99.95 3.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 74.43 110.934 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.3 t0 54.61 22.82 4.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.087 -0.506 . . . . 74.45 110.911 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 63.74 15.42 8.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 72.04 110.925 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -103.46 -40.89 6.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.07 -0.514 . . . . 65.0 110.897 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -122.24 164.22 18.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.194 -0.457 . . . . 74.54 110.902 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -134.63 130.5 36.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 74.35 110.857 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 8.5 mm -92.39 94.29 4.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 74.43 111.146 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -124.59 164.49 19.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.191 -0.459 . . . . 71.54 111.099 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.9 pttm -127.43 157.25 73.42 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.521 0.677 . . . . 64.32 110.926 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 138.12 37.2 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.683 2.256 . . . . 74.32 112.32 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 60.5 mt . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 73.43 111.15 179.852 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 N--CA 1.466 -0.096 0 CA-C-O 120.871 0.279 . . . . 64.11 112.363 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -115.83 -130.71 4.72 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.702 -0.761 . . . . 73.24 112.487 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -144.18 127.05 16.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.861 0.363 . . . . 75.54 110.913 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.2 p -135.13 129.85 19.09 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.672 0.749 . . . . 74.35 111.135 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.68 161.72 44.82 Favored 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.677 2.251 . . . . 72.23 112.346 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.0 t -83.06 -21.74 8.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.238 -0.437 . . . . 71.53 111.139 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.2 m -75.98 -4.7 42.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.124 -0.489 . . . . 74.25 110.888 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -126.16 -0.82 7.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.128 -0.487 . . . . 74.24 110.939 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -125.37 147.87 29.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.144 -0.48 . . . . 73.14 111.133 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.7 ttp180 -123.63 110.6 15.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 73.43 110.814 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.7 mp -65.76 111.44 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 74.45 111.146 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 3.5 pt -127.64 141.69 45.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 71.42 111.107 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -70.43 123.83 22.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 74.34 110.895 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.0 tp -56.35 -24.93 47.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 75.42 110.92 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.01 -29.38 16.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 74.51 110.878 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -143.09 78.49 15.14 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.618 0.723 . . . . 75.34 110.841 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 -7.36 20.85 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.668 2.245 . . . . 73.31 112.339 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.11 -7.58 38.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.435 . . . . 75.03 111.047 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -84.4 -52.22 6.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.3 -0.409 . . . . 75.35 110.863 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -97.48 23.88 7.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 73.05 110.914 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -85.41 -19.2 31.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 74.04 111.118 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 90.4 p -92.58 -24.13 18.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.237 -0.438 . . . . 65.42 110.859 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 9.0 p -52.07 155.56 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.477 . . . . 74.0 111.14 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -110.61 94.98 5.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.195 -0.457 . . . . 75.03 110.871 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.44 -38.64 77.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.175 -0.466 . . . . 70.55 111.119 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -55.1 -44.26 74.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.252 -0.431 . . . . 75.13 110.917 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -63.74 110.04 1.91 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.134 -0.485 . . . . 52.52 110.88 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.57 -28.69 21.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 73.44 110.878 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -66.97 -56.74 8.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 72.33 110.892 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -58.64 -55.15 38.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 74.11 110.89 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 5.5 p -53.92 -33.22 23.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 75.23 111.09 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 14.5 mtm -67.14 -53.5 30.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.231 -0.44 . . . . 74.02 110.834 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.1 mttm -56.18 -37.4 69.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 75.41 110.925 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 17.3 mt -66.77 -52.62 43.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 74.3 111.102 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 90.6 mt -63.25 -33.86 63.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 72.31 111.096 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -71.11 -46.2 62.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 71.0 110.885 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -68.53 -48.43 64.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.465 . . . . 73.42 110.844 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -68.75 -15.35 63.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.134 -0.485 . . . . 73.15 110.839 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt 59.95 49.56 7.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.147 -0.479 . . . . 70.2 110.884 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 24.5 mt -78.23 131.53 68.94 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.598 0.714 . . . . 72.43 111.177 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 164.32 34.97 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.701 2.268 . . . . 75.24 112.307 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -95.41 170.2 9.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.2 -0.455 . . . . 75.53 111.19 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 68.6 t -55.81 -54.65 24.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.272 -0.422 . . . . 64.1 111.122 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -51.95 -50.58 60.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 74.11 110.893 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -57.74 -44.39 86.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.489 . . . . 73.22 110.894 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 23.0 t90 -61.68 -43.0 99.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.208 -0.451 . . . . 73.21 110.921 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 5.1 mmpt? -60.65 -53.25 59.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 73.34 110.884 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -59.98 -37.82 80.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 74.35 110.904 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -61.06 -53.03 62.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.481 . . . . 73.51 110.904 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 62.24 111.15 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.826 0.346 . . . . 71.34 110.948 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 26.8 mm 53.06 76.31 0.54 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.653 0.739 . . . . 73.02 111.163 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.67 78.42 0.98 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.704 2.269 . . . . 75.32 112.386 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 14.5 t -81.13 -0.52 40.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 73.43 110.824 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -48.91 161.21 0.43 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.575 0.702 . . . . 74.23 110.874 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 -26.21 27.62 Favored 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.677 2.251 . . . . 64.35 112.344 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.29 85.84 0.15 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.591 0.71 . . . . 72.35 111.08 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 158.38 57.09 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.622 2.215 . . . . 75.53 112.367 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.94 160.45 33.79 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.582 0.706 . . . . 75.12 110.894 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 167.48 24.34 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.674 2.25 . . . . 74.52 112.345 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--N 1.342 0.195 0 C-N-CA 122.645 2.23 . . . . 75.21 112.37 179.95 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.846 0.355 . . . . 74.0 110.937 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -123.26 142.84 50.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.466 . . . . 72.14 110.875 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -122.76 150.49 42.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 73.2 111.057 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.1 p -116.07 129.08 73.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.176 -0.465 . . . . 74.43 111.127 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.39 132.46 47.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.453 . . . . 75.24 111.153 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.1 mt -102.71 -16.81 15.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.208 -0.451 . . . . 74.25 110.909 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -136.49 161.99 34.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.474 . . . . 71.42 110.924 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -86.87 114.26 23.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.086 -0.506 . . . . 72.23 110.865 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -100.2 130.08 46.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.115 -0.493 . . . . 73.34 110.88 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -104.21 109.36 21.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.12 -0.491 . . . . 74.32 110.913 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.86 159.58 16.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 73.43 111.114 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -116.57 -28.44 6.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 74.24 110.89 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -141.46 -174.52 4.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 74.3 110.846 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -64.71 -39.19 93.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.172 -0.467 . . . . 74.52 110.824 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -62.86 -18.4 62.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.222 -0.445 . . . . 75.13 110.85 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -110.2 140.12 44.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 73.33 110.912 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.6 tp -114.57 153.77 29.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 74.44 110.898 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -97.78 126.77 43.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.476 . . . . 62.34 110.864 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -125.51 159.29 33.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.246 -0.433 . . . . 74.33 111.16 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.4 m -124.27 159.25 58.01 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.654 0.74 . . . . 73.43 110.799 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 118.48 5.71 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.656 2.238 . . . . 73.22 112.329 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.02 -0.34 31.6 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.758 -0.734 . . . . 63.25 112.504 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -89.25 151.37 22.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.863 0.363 . . . . 74.44 110.888 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -96.61 112.63 24.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.136 -0.483 . . . . 65.43 110.881 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -112.25 142.04 45.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.193 -0.458 . . . . 73.12 110.905 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.72 112.48 24.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 71.32 110.85 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 31.3 mm -66.94 144.89 14.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 71.43 111.117 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.5 m -122.46 -42.09 2.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.169 -0.469 . . . . 74.21 110.904 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -171.77 168.97 6.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 62.54 111.117 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -119.45 178.31 4.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 65.43 110.861 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -148.69 105.7 3.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 71.01 110.854 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 56.54 22.52 6.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.084 -0.507 . . . . 75.43 110.866 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 57.78 22.78 8.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 74.51 110.939 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -121.06 -5.47 9.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.119 -0.491 . . . . 74.31 110.935 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -152.51 158.8 43.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.11 -0.495 . . . . 74.11 110.89 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -141.55 151.67 43.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.458 . . . . 72.34 110.888 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 6.3 mm -109.49 94.03 2.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.191 -0.459 . . . . 73.51 111.121 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -107.25 146.03 31.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 75.24 111.159 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -118.0 155.56 51.07 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.584 0.706 . . . . 75.51 110.93 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 123.7 10.35 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.66 2.24 . . . . 73.22 112.329 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 69.5 mt . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 70.24 111.123 179.962 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 N--CA 1.465 -0.164 0 CA-C-O 120.831 0.263 . . . . 70.3 112.365 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -129.71 -146.44 6.04 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.739 -0.743 . . . . 61.43 112.477 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -137.04 124.75 22.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.828 0.347 . . . . 73.4 110.889 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.5 p -134.26 132.25 21.0 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.636 0.731 . . . . 71.33 111.109 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . 0.419 ' HG2' ' HB2' ' A' ' 54' ' ' TYR . 53.6 Cg_endo -69.8 158.36 57.19 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.677 2.251 . . . . 72.35 112.328 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.7 t -76.3 -20.86 15.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 75.43 111.128 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.4 m -79.71 0.95 28.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 73.44 110.856 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . 0.419 ' HB2' ' HG2' ' A' ' 51' ' ' PRO . 7.5 m-85 -118.75 -27.13 5.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.145 -0.48 . . . . 75.41 110.959 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 13.1 m -106.23 147.9 11.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.081 -0.508 . . . . 70.1 111.123 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.4 ttp180 -117.66 110.9 18.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 73.21 110.874 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.6 mp -68.76 112.39 3.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 64.41 111.125 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 7.1 pt -125.22 167.16 19.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.455 . . . . 74.25 111.171 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -102.42 125.39 49.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 64.53 110.895 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.3 mt -56.22 -24.7 43.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 72.54 110.951 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.75 -29.92 18.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.15 -0.477 . . . . 73.14 110.856 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -145.92 74.74 13.27 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.596 0.712 . . . . 63.44 110.898 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 -8.83 24.61 Favored 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.711 2.274 . . . . 73.41 112.359 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.96 -5.9 36.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 73.33 111.078 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.2 ttmm -84.1 -51.97 6.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 73.34 110.884 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -90.67 -0.08 57.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.444 . . . . 75.52 110.895 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.3 -17.86 55.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 62.03 111.12 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 86.2 p -76.62 -24.16 53.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.25 -0.432 . . . . 75.34 110.817 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 14.2 t -77.77 121.76 31.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 74.24 111.11 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -90.25 11.68 20.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 73.21 110.835 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.0 p 45.91 33.7 1.69 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.471 . . . . 75.52 111.163 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -104.12 -54.83 2.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 73.05 110.951 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.86 115.44 4.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 75.02 110.812 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.04 -28.99 19.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.457 . . . . 73.03 110.896 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -66.61 -49.04 67.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 74.0 110.909 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -62.95 -57.0 12.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 74.51 110.961 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 1.7 p -54.31 -31.7 22.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 64.34 111.162 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 11.5 mtm -67.91 -54.11 21.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.492 . . . . 63.44 110.844 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 34.8 mttt -57.55 -35.79 70.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 75.5 110.901 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 41.8 mt -67.71 -50.47 60.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 74.21 111.118 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 96.4 mt -65.64 -35.7 75.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 73.21 111.084 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -71.21 -52.05 21.24 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 72.3 110.886 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -58.57 -52.69 64.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.185 -0.461 . . . . 73.32 110.923 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -67.95 -15.51 63.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 73.53 110.885 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.8 mmtm 60.94 54.98 3.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.486 . . . . 65.42 110.942 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 21.2 mt -82.25 131.3 56.52 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.622 0.725 . . . . 71.24 111.129 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.72 162.81 40.59 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.654 2.236 . . . . 73.23 112.346 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.19 171.48 7.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.196 -0.456 . . . . 75.23 111.13 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 85.8 t -51.94 -53.98 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 62.43 111.148 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 69.2 mt-10 -51.68 -51.99 51.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 74.32 110.853 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 60.4 mm-40 -59.21 -43.88 92.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.446 . . . . 64.43 110.939 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 32.9 t90 -62.61 -38.75 91.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 71.51 110.893 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 5.8 mmpt? -64.95 -52.8 54.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 71.3 110.867 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.23 -41.92 85.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.234 -0.439 . . . . 73.21 110.879 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -63.09 -46.44 87.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.225 -0.443 . . . . 65.45 110.947 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.1 p . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.451 . . . . 71.31 111.152 -179.925 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.782 0.325 . . . . 74.43 110.857 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 22.0 mm 56.48 77.88 0.4 Allowed Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.663 0.744 . . . . 71.03 111.16 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.82 86.9 0.57 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.635 2.223 . . . . 73.25 112.365 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 13.2 t -80.4 -1.39 41.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.456 . . . . 75.53 110.862 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.92 163.2 0.43 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.628 0.727 . . . . 74.25 110.85 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 -22.64 31.87 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.686 2.258 . . . . 74.34 112.385 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.63 84.07 0.19 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.577 0.703 . . . . 74.2 111.135 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 163.24 38.97 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.721 2.28 . . . . 74.31 112.368 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -100.14 160.47 27.02 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.601 0.715 . . . . 72.22 110.879 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 163.84 36.77 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.691 2.261 . . . . 72.22 112.339 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 C--N 1.341 0.148 0 C-N-CA 122.702 2.268 . . . . 74.12 112.319 179.94 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.891 0.376 . . . . 75.14 110.913 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -116.8 163.9 15.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.469 . . . . 65.1 110.93 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -142.91 164.02 31.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 72.22 111.099 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 10.9 p -130.71 130.89 64.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 63.44 111.143 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.86 139.6 47.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 74.44 111.09 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 23.3 mt -114.07 -11.22 12.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 65.33 110.915 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -137.01 159.63 41.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 74.02 110.892 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -85.74 108.85 18.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 75.53 110.871 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -93.63 139.28 30.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 75.25 110.855 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -112.97 97.1 6.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.118 -0.492 . . . . 74.41 110.927 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.67 157.36 1.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.451 . . . . 72.12 111.108 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -115.82 -32.97 5.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 73.23 110.894 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -133.11 -178.45 4.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 74.01 110.886 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -63.47 -41.34 98.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.207 -0.451 . . . . 71.11 110.832 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -57.32 -23.68 50.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.211 -0.45 . . . . 63.03 110.901 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.0 152.23 19.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 72.33 110.908 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.2 tt -131.77 120.55 22.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.138 -0.483 . . . . 73.15 110.945 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -63.73 143.62 57.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.235 -0.439 . . . . 74.54 110.836 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -139.95 159.11 26.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 74.13 111.144 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.3 m -121.44 158.07 54.57 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.671 0.748 . . . . 73.32 110.861 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.72 117.96 5.39 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.709 2.273 . . . . 75.52 112.375 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.06 4.66 31.14 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.737 -0.744 . . . . 55.04 112.448 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -92.12 154.59 18.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.85 0.357 . . . . 74.52 110.869 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -105.61 115.82 30.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 72.5 110.92 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.7 mp -116.55 155.35 28.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.201 -0.454 . . . . 71.45 110.938 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.5 t -108.26 112.79 25.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 73.04 110.895 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 57.4 mt -75.72 144.86 11.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 64.0 111.146 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.8 m -116.23 -43.94 2.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.144 -0.48 . . . . 72.41 110.924 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -161.02 174.8 13.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 71.11 111.115 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -121.18 177.95 4.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 75.52 110.829 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.407 ' HB3' ' HB2' ' A' ' 36' ' ' TRP . 20.2 t80 -146.87 100.83 3.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.206 -0.452 . . . . 71.42 110.91 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.415 ' HB3' ' CG ' ' A' ' 35' ' ' GLU . 33.6 t0 59.97 17.5 6.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.098 -0.501 . . . . 64.22 110.905 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 63.47 29.65 15.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.169 -0.469 . . . . 72.3 110.939 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.415 ' CG ' ' HB3' ' A' ' 33' ' ' ASP . 4.4 pt-20 -131.16 -1.76 4.02 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.101 -0.499 . . . . 64.54 110.921 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.422 ' CZ2' ' HB2' ' B' ' -3' ' ' ARG . 88.1 m95 -152.73 135.52 15.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.107 -0.497 . . . . 74.14 110.905 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -121.78 131.38 54.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.259 -0.428 . . . . 75.12 110.871 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.4 mm -87.04 94.55 4.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 74.4 111.154 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -111.1 138.99 46.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 74.43 111.106 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 51.2 pttt -112.82 153.67 45.07 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.55 0.69 . . . . 74.52 110.903 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 119.56 6.49 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.664 2.243 . . . . 65.3 112.394 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.4 mt . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 75.54 111.16 179.911 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo . . . . . 0 C--O 1.23 0.113 0 CA-C-O 120.803 0.251 . . . . 73.44 112.348 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -105.6 -106.47 3.12 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.752 -0.737 . . . . 72.51 112.455 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.3 tt -163.55 124.73 2.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.837 0.351 . . . . 72.25 110.935 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.3 p -137.56 133.8 18.15 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.658 0.742 . . . . 74.11 111.074 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 153.85 68.36 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.661 2.241 . . . . 75.02 112.355 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.9 t -72.59 -21.01 19.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 73.12 111.148 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.0 m -77.0 -2.58 34.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 71.11 110.837 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -127.22 22.8 6.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.107 -0.497 . . . . 74.13 110.881 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 10.7 m -148.63 163.23 5.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.119 -0.491 . . . . 74.0 111.155 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 26.1 ttm180 -130.57 119.09 21.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.461 . . . . 73.43 110.883 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 43.2 mm -70.13 108.8 2.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.456 . . . . 75.42 111.152 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.4 pt -134.18 132.82 55.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 73.32 111.15 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -67.34 145.77 54.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 63.32 110.868 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.31 -36.67 71.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 73.52 110.911 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.24 -24.49 32.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 74.31 110.898 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -148.76 74.17 10.34 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.607 0.717 . . . . 62.11 110.904 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -8.57 23.95 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.688 2.259 . . . . 72.22 112.331 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.46 -18.46 23.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 72.55 111.113 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.8 ttmt -74.62 -50.32 18.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 73.12 110.921 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -95.25 23.27 5.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 75.31 110.939 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -89.48 11.71 18.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.13 -0.486 . . . . 64.04 111.11 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.7 p -114.87 -24.04 8.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 72.52 110.869 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 7.9 p -55.18 140.24 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.145 -0.48 . . . . 71.32 111.134 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -99.44 93.72 6.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 72.43 110.887 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -50.84 -30.15 13.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 70.41 111.127 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -57.38 -51.02 71.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 75.52 110.876 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -63.99 110.11 2.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.172 -0.467 . . . . 70.32 110.824 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -24.29 39.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 74.45 110.865 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -66.87 -52.96 37.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 74.32 110.858 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -60.15 -58.45 8.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 75.01 110.943 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 2.6 p -51.63 -32.27 13.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 74.35 111.162 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.8 mtm -68.16 -51.73 42.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 70.04 110.93 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.1 mttm -55.39 -47.07 76.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.209 -0.451 . . . . 74.32 110.94 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.7 mp -60.98 -53.73 45.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 75.2 111.153 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 82.0 mt -57.35 -36.05 51.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.154 -0.476 . . . . 71.54 111.138 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -71.16 -51.9 22.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 75.51 110.883 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -59.14 -49.4 78.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.445 . . . . 74.45 110.924 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -67.9 -15.88 63.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 75.55 110.868 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 29.6 mmtm 61.31 49.51 5.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 75.43 110.873 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 38.2 mt -79.14 125.16 84.04 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.598 0.714 . . . . 73.13 111.158 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.68 168.72 20.63 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.699 2.266 . . . . 72.42 112.342 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.77 167.04 14.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 71.44 111.125 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.2 t -51.04 -58.88 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.205 -0.452 . . . . 74.51 111.139 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -51.28 -48.04 62.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.481 . . . . 73.05 110.877 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -56.8 -33.48 66.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.465 . . . . 75.42 110.886 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 22.3 t90 -66.78 -41.01 88.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.241 -0.436 . . . . 75.01 110.888 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 16.7 mtmt -67.4 -49.32 64.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 74.15 110.915 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -61.6 -39.7 92.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 55.14 110.836 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -65.27 -48.84 71.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 72.51 110.937 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 3.6 p . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 75.01 111.141 -179.958 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.823 0.344 . . . . 73.35 110.898 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 28.8 mm 50.1 78.18 0.42 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.612 0.72 . . . . 74.22 111.149 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 88.75 0.53 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.689 2.259 . . . . 73.42 112.356 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 36.8 p -78.6 -2.8 40.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 62.34 110.839 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' -3' ' ' ARG . . . . . 0.422 ' HB2' ' CZ2' ' A' ' 36' ' ' TRP . 22.3 mmm-85 -49.92 160.53 0.63 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.616 0.722 . . . . 75.54 110.853 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 -19.27 36.61 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.673 2.249 . . . . 74.23 112.337 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.54 84.29 0.18 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.596 0.712 . . . . 72.01 111.135 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.66 160.06 51.14 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.717 2.278 . . . . 73.51 112.365 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.75 160.47 27.8 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.543 0.687 . . . . 63.24 110.884 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 167.28 24.91 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.658 2.238 . . . . 72.42 112.338 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo . . . . . 0 C--N 1.342 0.193 0 C-N-CA 122.705 2.27 . . . . 62.31 112.313 179.984 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.833 0.349 . . . . 72.43 110.899 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -140.89 139.8 34.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 75.22 110.889 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.22 159.61 34.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.113 -0.494 . . . . 72.44 111.094 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 p -127.75 120.9 55.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.259 -0.428 . . . . 73.32 111.166 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.98 128.48 36.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 71.2 111.143 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 33.9 mt -101.57 -15.54 17.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.225 -0.443 . . . . 64.52 110.927 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -137.51 157.68 46.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 75.54 110.948 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -80.08 105.09 11.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.099 -0.5 . . . . 72.4 110.925 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -93.55 101.08 13.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 64.33 110.887 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.34 121.54 25.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.474 . . . . 75.5 110.915 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.59 146.84 52.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 71.32 111.095 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -116.34 -26.63 7.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.238 -0.437 . . . . 75.22 110.853 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -124.36 178.53 5.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 75.23 110.862 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -68.8 -26.71 65.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.192 -0.458 . . . . 74.35 110.849 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -77.36 -31.56 54.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 73.44 110.898 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -74.36 148.49 41.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 72.42 110.907 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.7 tp -122.31 134.79 54.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.191 -0.459 . . . . 70.22 110.906 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -80.41 132.44 35.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.444 . . . . 75.34 110.852 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.7 p -146.38 147.05 18.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 71.53 111.115 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.3 m -107.83 160.27 27.42 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.667 0.746 . . . . 73.2 110.849 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 125.91 12.68 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.7 2.266 . . . . 74.34 112.315 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.05 1.5 31.7 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.777 -0.725 . . . . 50.11 112.523 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -92.23 163.85 13.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.854 0.359 . . . . 64.42 110.927 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -113.19 122.02 46.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 75.51 110.879 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -117.1 151.69 36.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 75.22 110.925 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.78 112.58 24.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.469 . . . . 74.24 110.886 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 68.9 mt -77.88 143.35 12.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.107 -0.497 . . . . 71.44 111.124 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -118.94 -41.74 2.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.159 -0.473 . . . . 74.35 110.883 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -158.95 174.17 15.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.231 -0.441 . . . . 72.22 111.111 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -127.71 178.84 5.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.449 . . . . 73.24 110.869 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -138.34 100.25 4.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 75.32 110.895 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 45.9 t0 54.98 25.49 6.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 71.1 110.856 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 63.86 16.03 9.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.244 -0.435 . . . . 73.45 110.927 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -103.46 -50.04 3.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 75.35 110.866 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 81.6 m95 -112.42 164.64 13.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.12 -0.491 . . . . 73.44 110.923 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -138.23 155.94 48.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 73.54 110.884 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 11.5 mm -113.94 94.29 3.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.133 -0.485 . . . . 73.53 111.079 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -108.28 146.69 32.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 54.13 111.078 179.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.3 mttm -115.79 153.91 48.09 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.571 0.701 . . . . 72.42 110.886 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 118.67 5.82 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.664 2.242 . . . . 75.13 112.311 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 30.6 mt . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.189 -0.46 . . . . 71.11 111.149 179.882 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 N--CA 1.466 -0.143 0 CA-C-O 120.825 0.26 . . . . 73.42 112.329 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -117.86 -131.27 4.44 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.752 -0.737 . . . . 72.23 112.488 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.04 128.35 15.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.845 0.355 . . . . 74.23 110.91 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.7 p -142.98 131.06 11.23 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.616 0.722 . . . . 73.24 111.146 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 163.0 39.96 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.698 2.266 . . . . 75.1 112.283 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 9.6 t -69.88 -21.64 24.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.221 -0.445 . . . . 74.24 111.155 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.2 m -80.48 -0.23 36.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.145 -0.48 . . . . 74.45 110.83 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -124.36 12.88 8.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.132 -0.486 . . . . 74.2 110.945 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 10.3 m -152.84 139.27 12.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 73.22 111.164 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -112.08 119.74 39.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 73.05 110.861 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 16.5 mm -66.54 109.29 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 75.15 111.162 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.2 pt -131.6 128.19 60.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.466 . . . . 74.32 111.157 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.72 126.28 27.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 74.22 110.89 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.1 tp -58.26 -29.77 66.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 73.4 110.941 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 9.0 mmt -88.64 -1.45 58.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 74.42 110.849 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -170.88 82.6 0.53 Allowed Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.602 0.715 . . . . 75.33 110.909 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 -7.12 20.23 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.678 2.252 . . . . 74.52 112.398 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -100.69 -2.64 32.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 71.35 111.14 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.3 ttpt -81.58 -52.55 7.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 75.35 110.888 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -104.24 23.51 12.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.271 -0.422 . . . . 74.14 110.934 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.88 -18.24 51.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 72.45 111.117 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.8 p -106.12 22.85 15.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 71.0 110.875 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 8.0 p -90.86 149.2 4.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.15 -0.477 . . . . 74.01 111.165 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -98.61 83.85 3.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 62.35 110.87 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.25 -44.57 61.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 74.11 111.113 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -54.15 -40.63 67.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 73.13 110.943 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 61.4 t0 -63.71 107.34 1.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.491 . . . . 73.13 110.843 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.7 -28.56 22.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 75.25 110.831 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -66.89 -56.26 11.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 74.32 110.874 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -59.25 -56.1 26.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 65.43 110.908 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.5 p -53.14 -32.12 18.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 75.34 111.135 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 12.2 mtm -67.47 -54.55 19.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 75.43 110.887 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.6 mttp -55.63 -39.28 70.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.445 . . . . 72.11 110.906 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 83.3 mt -64.34 -54.9 25.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 71.04 111.156 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 97.1 mt -59.91 -35.36 60.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 75.21 111.166 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -69.09 -49.38 57.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.175 -0.466 . . . . 60.43 110.894 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -62.23 -43.57 98.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 73.33 110.879 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -75.5 -18.23 59.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 74.35 110.857 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 60.1 mmtt 63.18 49.53 3.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 72.42 110.904 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 21.1 mt -77.33 129.65 77.02 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.618 0.723 . . . . 74.43 111.156 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 163.29 38.8 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.704 2.269 . . . . 74.4 112.356 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.85 166.17 12.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.248 -0.433 . . . . 72.1 111.108 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 91.4 t -50.66 -54.58 9.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 65.34 111.128 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -51.34 -49.11 62.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.173 -0.467 . . . . 73.44 110.917 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -56.98 -46.47 82.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 72.12 110.919 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -59.14 -37.79 78.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.228 -0.442 . . . . 74.21 110.91 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.09 -43.53 82.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.231 -0.44 . . . . 75.41 110.892 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -65.5 -36.07 82.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.263 -0.426 . . . . 73.53 110.858 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -72.96 -38.0 66.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 73.3 110.913 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 5.9 p . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 73.43 111.168 -179.929 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.783 0.325 . . . . 71.41 110.845 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 31.2 mm 51.18 81.42 0.26 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.649 0.738 . . . . 73.22 111.146 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 81.7 0.81 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.676 2.251 . . . . 65.2 112.323 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 40.6 t -89.06 3.0 53.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.24 -0.436 . . . . 74.01 110.84 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -50.97 162.83 0.55 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.606 0.717 . . . . 73.34 110.836 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 -23.05 31.36 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.684 2.256 . . . . 72.4 112.344 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.01 90.49 0.09 OUTLIER Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.583 0.706 . . . . 74.13 111.07 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 158.41 57.0 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.71 2.273 . . . . 71.14 112.311 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.97 150.38 40.47 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.566 0.698 . . . . 74.35 110.926 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 166.21 28.36 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.622 2.214 . . . . 73.12 112.358 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--O 1.231 0.168 0 C-N-CA 122.656 2.237 . . . . 75.5 112.342 179.976 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.835 0.35 . . . . 74.11 110.932 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -139.49 163.42 32.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 75.1 110.887 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -134.44 167.15 21.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.149 -0.478 . . . . 71.03 111.098 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.3 p -128.51 128.86 68.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 74.32 111.157 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -72.16 138.42 47.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 63.43 111.132 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 18.0 mt -114.47 -15.39 12.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.229 -0.441 . . . . 73.01 110.956 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -137.42 158.35 44.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.139 -0.482 . . . . 74.11 110.927 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -83.04 104.83 13.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.1 -0.5 . . . . 73.51 110.874 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -88.96 103.81 16.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.192 -0.458 . . . . 73.13 110.892 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.1 mttm -79.4 112.05 16.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 72.41 110.918 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.85 163.11 28.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.237 -0.438 . . . . 72.02 111.122 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -119.01 -31.46 4.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.456 . . . . 73.44 110.909 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.1 mmm-85 -139.38 -174.76 3.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 75.34 110.814 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -64.54 -39.93 94.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 73.35 110.823 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.41 -28.0 40.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.194 -0.457 . . . . 73.32 110.87 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -88.98 -178.16 5.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 74.42 110.909 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.6 tp -150.41 123.18 8.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.122 -0.49 . . . . 74.32 110.912 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -80.53 124.52 29.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.214 -0.448 . . . . 72.35 110.913 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.4 p -139.53 155.06 25.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.441 . . . . 70.41 111.123 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.0 m -111.11 159.34 33.08 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.65 0.738 . . . . 75.22 110.829 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 123.01 9.67 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.642 2.228 . . . . 72.41 112.32 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.41 -3.32 32.81 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.775 -0.726 . . . . 72.34 112.488 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -89.98 145.7 24.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.891 0.377 . . . . 75.31 110.874 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -86.67 142.06 28.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 75.31 110.842 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.3 mp -144.46 151.91 39.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.466 . . . . 74.14 110.922 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.5 t -107.08 125.56 51.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 74.24 110.876 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 53.5 mt -86.06 143.97 10.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 72.25 111.146 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 23.5 m -112.55 -37.72 4.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.18 -0.464 . . . . 74.05 110.922 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -164.27 176.16 9.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 74.51 111.129 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -126.61 178.26 6.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 74.41 110.876 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -141.03 99.65 3.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.211 -0.45 . . . . 75.2 110.903 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 54.92 24.01 5.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.129 -0.487 . . . . 62.01 110.858 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 63.6 15.3 8.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.201 -0.454 . . . . 75.03 110.92 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -103.32 -49.17 3.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.498 . . . . 74.43 110.896 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -114.52 146.16 41.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 75.43 110.918 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -119.18 149.11 42.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.435 . . . . 75.34 110.897 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.2 mm -108.53 96.27 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 74.25 111.103 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -105.71 161.62 14.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 73.2 111.133 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -136.59 158.32 73.45 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.534 0.683 . . . . 73.54 110.879 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.79 131.87 22.1 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.689 2.26 . . . . 71.44 112.372 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 27.0 mm . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.446 . . . . 75.13 111.104 179.945 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.231 0.139 0 CA-C-O 120.813 0.255 . . . . 74.41 112.337 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -126.19 -105.34 1.44 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.719 -0.753 . . . . 62.21 112.447 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -162.63 125.69 2.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.85 0.357 . . . . 73.14 110.896 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 10.0 p -136.51 132.99 18.95 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.583 0.706 . . . . 74.42 111.107 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 144.87 55.53 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.686 2.257 . . . . 61.41 112.347 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 18.4 t -58.24 -22.15 19.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 72.24 111.16 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.1 m -77.61 -2.55 36.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.476 . . . . 71.52 110.814 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -125.82 22.93 7.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.485 . . . . 73.35 110.91 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 1.7 m -156.27 154.75 6.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.121 -0.491 . . . . 74.02 111.121 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 37.6 ttm-85 -121.41 128.44 52.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 74.54 110.873 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.5 mm -76.72 110.02 11.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.183 -0.462 . . . . 62.22 111.136 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 7.0 pt -126.13 -177.78 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.479 . . . . 62.33 111.082 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -126.09 124.48 40.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.162 -0.472 . . . . 55.54 110.895 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.02 -26.39 36.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 74.43 110.913 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.6 mpp? -90.17 -25.57 20.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 73.03 110.917 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -147.83 75.0 11.11 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.601 0.715 . . . . 63.41 110.872 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 -8.39 23.49 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.676 2.251 . . . . 73.43 112.331 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -100.14 -12.92 19.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 72.23 111.132 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.5 ttmm -80.02 -52.1 8.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.908 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -95.45 23.11 6.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.446 . . . . 75.43 110.931 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -90.06 9.91 26.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 75.42 111.101 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 64.4 p -116.62 -24.13 7.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.221 -0.445 . . . . 74.45 110.796 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 13.9 p -56.65 135.28 20.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.17 -0.468 . . . . 71.34 111.12 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -90.33 100.67 13.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 74.14 110.848 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.78 -30.47 65.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 73.02 111.115 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -62.72 -44.64 95.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.228 -0.442 . . . . 73.32 110.916 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.6 t0 -63.72 106.56 1.0 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.491 . . . . 72.52 110.869 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.44 -27.94 27.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 75.35 110.851 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -66.52 -54.46 23.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 75.42 110.884 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -59.75 -57.62 12.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.146 -0.479 . . . . 73.45 110.912 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 4.3 p -51.89 -32.76 15.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 75.43 111.12 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 16.5 mtm -67.87 -50.82 54.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 74.41 110.902 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.4 mttt -56.28 -43.86 79.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.254 -0.43 . . . . 75.15 110.854 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.6 mp -63.97 -54.82 26.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 74.11 111.131 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 87.2 mt -57.68 -37.02 56.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.222 -0.445 . . . . 72.53 111.129 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -71.07 -51.71 23.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.21 -0.45 . . . . 64.33 110.834 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -59.47 -50.26 74.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 75.05 110.898 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -67.88 -13.42 62.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 75.11 110.906 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 63.1 mmtt 61.11 48.36 6.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.097 -0.501 . . . . 73.43 110.906 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 24.6 mt -81.66 122.43 80.48 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.651 0.739 . . . . 74.13 111.118 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.8 159.49 53.2 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.703 2.269 . . . . 72.53 112.32 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -81.38 174.81 11.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.216 -0.447 . . . . 73.42 111.1 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 24.1 t -53.81 -58.53 3.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.459 . . . . 73.54 111.136 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -50.75 -47.68 59.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 72.33 110.874 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -56.12 -39.24 71.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.458 . . . . 74.45 110.912 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -62.03 -48.43 80.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 73.44 110.89 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 17.7 mtmt -58.09 -50.79 72.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.217 -0.447 . . . . 73.23 110.897 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -58.35 -51.68 68.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.258 -0.428 . . . . 71.24 110.865 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -50.63 -52.56 38.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 75.4 110.897 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 75.22 111.118 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.87 0.367 . . . . 73.24 110.866 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 3.5 mp 47.95 84.73 0.19 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.618 0.723 . . . . 74.41 111.103 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 85.53 0.61 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.688 2.259 . . . . 74.41 112.361 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 1.3 t -74.28 -8.47 56.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.216 -0.447 . . . . 61.34 110.888 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.08 160.39 6.37 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.609 0.719 . . . . 71.21 110.872 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 154.65 67.72 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.688 2.258 . . . . 74.33 112.333 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -107.92 87.42 3.73 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.565 0.698 . . . . 75.45 111.108 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 149.0 66.57 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.721 2.281 . . . . 74.32 112.374 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.0 159.91 64.5 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.58 0.705 . . . . 74.44 110.86 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 167.11 25.46 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.626 2.217 . . . . 55.35 112.351 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--O 1.231 0.151 0 C-N-CA 122.69 2.26 . . . . 74.54 112.335 179.993 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.825 0.345 . . . . 72.53 110.96 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -128.23 163.14 25.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.209 -0.45 . . . . 73.52 110.913 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -134.6 170.05 16.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 73.52 111.122 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.4 p -133.14 131.27 58.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 74.32 111.092 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.05 134.53 41.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 71.04 111.171 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.6 mt -109.22 -13.05 14.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 72.55 110.919 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -137.31 156.23 48.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 70.14 110.896 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -83.55 104.98 14.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.11 -0.495 . . . . 54.45 110.886 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -108.72 102.43 11.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.178 -0.465 . . . . 74.21 110.848 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp -78.96 124.34 28.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.114 -0.494 . . . . 75.31 110.928 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.41 145.4 56.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 72.24 111.105 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -96.65 -31.62 12.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 74.22 110.899 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -140.21 179.17 6.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.136 -0.484 . . . . 75.24 110.907 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -59.87 -29.78 68.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.216 -0.447 . . . . 75.04 110.906 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -65.15 -24.56 67.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 74.21 110.868 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -104.79 147.92 27.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.459 . . . . 71.43 110.896 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 tp -118.12 119.18 33.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.165 -0.47 . . . . 74.41 110.965 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -57.31 141.34 47.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 63.54 110.865 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -145.4 158.69 13.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 74.24 111.124 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.5 m -129.09 160.32 64.33 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.656 0.741 . . . . 73.11 110.877 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 119.46 6.41 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.687 2.258 . . . . 72.24 112.374 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.49 -0.46 30.86 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.741 -0.742 . . . . 65.4 112.468 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -88.24 166.0 14.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.82 0.343 . . . . 70.21 110.888 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -117.38 127.03 53.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 64.43 110.917 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.2 mp -127.41 158.99 35.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 74.34 110.917 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.0 t -111.13 114.87 28.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 74.2 110.878 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 57.2 mt -79.69 144.61 10.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 75.13 111.143 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 29.3 m -118.36 -41.65 2.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 74.34 110.899 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -155.67 174.63 15.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 74.42 111.093 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -126.89 177.73 6.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 70.21 110.868 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.2 t80 -139.91 99.56 3.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 75.32 110.941 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 55.11 25.16 6.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 64.02 110.843 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 63.48 16.3 9.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.225 -0.443 . . . . 74.11 110.935 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -103.62 -50.32 3.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 73.51 110.935 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.405 ' CZ2' ' HB2' ' B' ' -3' ' ' ARG . 78.5 m95 -113.06 153.78 27.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.09 -0.505 . . . . 75.54 110.923 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -126.38 142.64 51.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.25 -0.432 . . . . 71.32 110.933 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 21.7 mm -99.16 95.64 4.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.154 -0.475 . . . . 74.44 111.109 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -108.1 152.86 23.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.461 . . . . 73.14 111.13 179.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.2 mtpt -125.1 159.49 59.03 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.589 0.709 . . . . 74.43 110.905 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.7 139.74 41.17 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.67 2.247 . . . . 74.55 112.381 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 44.2 mt . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.447 . . . . 75.31 111.177 179.884 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.827 0.261 . . . . 64.54 112.357 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -116.91 -111.8 2.65 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.751 -0.738 . . . . 72.22 112.518 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -172.12 124.61 0.52 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.843 0.354 . . . . 73.13 110.949 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.1 p -139.46 132.98 15.65 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.58 0.705 . . . . 64.3 111.146 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.75 160.58 49.19 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.66 2.24 . . . . 73.23 112.325 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 8.4 t -72.11 -20.97 20.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 75.3 111.114 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.0 m -79.15 -0.17 30.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 72.44 110.832 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -127.49 17.36 7.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 73.5 110.947 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.8 m -151.87 161.15 3.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.086 -0.507 . . . . 71.03 111.115 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 39.0 ttm-85 -128.99 131.75 47.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.166 -0.47 . . . . 74.35 110.845 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 31.1 mm -80.59 108.85 14.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 75.43 111.124 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 4.6 pt -126.81 140.19 49.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 75.41 111.078 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -76.36 128.57 35.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.136 -0.483 . . . . 71.05 110.872 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.42 -34.97 74.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.181 -0.463 . . . . 73.34 110.872 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.1 mmt -83.78 -1.6 54.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 74.13 110.894 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -178.91 82.93 0.21 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.665 0.745 . . . . 62.02 110.884 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.81 -7.93 22.31 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.704 2.27 . . . . 71.31 112.284 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.46 -8.49 44.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 73.12 111.146 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -81.97 -47.09 13.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 74.14 110.883 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -103.72 23.47 12.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 74.24 110.916 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -84.23 -16.87 41.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 73.45 111.09 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 39.8 p -94.18 -23.76 17.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 71.34 110.829 -179.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 9.8 p -51.33 155.95 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.083 -0.508 . . . . 74.43 111.168 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -113.31 106.77 15.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 75.42 110.857 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.5 -20.81 62.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.445 . . . . 75.03 111.14 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -62.77 -54.91 31.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.231 -0.441 . . . . 74.11 110.91 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -63.89 116.73 6.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 73.54 110.893 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.48 -22.14 41.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 75.21 110.896 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -66.84 -56.01 12.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.175 -0.466 . . . . 74.34 110.928 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -58.71 -57.12 14.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 72.52 110.924 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.2 p -52.72 -31.91 16.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 73.2 111.13 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.8 mtm -67.57 -55.12 14.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 73.03 110.865 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 50.8 mttt -55.36 -38.64 69.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 75.24 110.944 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 15.4 mt -65.3 -53.08 44.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.226 -0.443 . . . . 73.53 111.105 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 96.1 mt -61.95 -35.9 70.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 74.42 111.145 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -71.02 -44.77 65.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 72.43 110.905 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -67.89 -47.84 67.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 71.2 110.891 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -69.21 -11.5 60.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 74.5 110.86 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 45.9 mmtt 58.32 53.89 6.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.461 . . . . 72.45 110.887 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 23.7 mt -88.14 124.33 66.88 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 75.24 111.134 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 164.15 35.63 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.642 2.228 . . . . 71.14 112.33 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.97 167.33 13.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 75.42 111.128 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . 0.478 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 97.7 t -50.61 -58.41 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 75.11 111.122 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -46.05 -53.16 10.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 72.13 110.906 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 74.9 mm-40 -56.38 -34.16 66.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 63.01 110.913 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . 0.408 ' HA ' ' HG2' ' A' ' 95' ' ' GLN . 26.8 t90 -71.25 -36.2 71.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.199 -0.455 . . . . 75.5 110.878 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 89' ' ' VAL . 1.6 mmmt -68.62 -37.56 79.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.451 . . . . 74.34 110.917 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -71.38 -50.83 28.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.227 -0.442 . . . . 74.23 110.888 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . 0.408 ' HG2' ' HA ' ' A' ' 92' ' ' TRP . 5.1 pt20 -58.8 -38.83 79.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.194 -0.457 . . . . 73.13 110.867 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 26.2 p . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.251 -0.431 . . . . 72.12 111.093 -179.902 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.848 0.356 . . . . 73.45 110.91 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.8 mm 51.41 74.37 0.81 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.651 0.739 . . . . 71.1 111.119 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 101.26 0.9 Allowed 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.703 2.268 . . . . 75.04 112.326 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 24.2 t -89.33 1.47 55.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 71.1 110.841 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' -3' ' ' ARG . . . . . 0.405 ' HB2' ' CZ2' ' A' ' 36' ' ' TRP . 19.7 mmt-85 -50.75 160.38 0.79 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.589 0.709 . . . . 74.44 110.915 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 -22.88 31.62 Favored 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.725 2.283 . . . . 70.24 112.354 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.6 85.03 0.17 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.585 0.707 . . . . 74.33 111.122 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 159.45 53.41 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.742 2.295 . . . . 74.52 112.303 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 11.4 mtpt -94.7 160.08 32.12 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.565 0.698 . . . . 74.13 110.9 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 166.66 26.76 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.668 2.245 . . . . 74.23 112.369 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo . . . . . 0 C--O 1.231 0.145 0 C-N-CA 122.7 2.267 . . . . 71.41 112.332 179.936 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 pt? . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.814 0.34 . . . . 74.32 110.932 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -112.06 145.15 40.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.258 -0.428 . . . . 75.04 110.893 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -126.66 153.57 45.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 73.31 111.118 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.6 p -121.66 122.5 67.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.24 -0.436 . . . . 74.41 111.129 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -59.18 140.17 56.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 73.12 111.126 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.5 mt -106.04 -16.42 14.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 71.21 110.907 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -139.25 164.31 30.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 74.12 110.911 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -87.19 104.8 16.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 72.01 110.895 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -106.74 109.37 21.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 73.23 110.86 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -83.84 142.24 30.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.105 -0.498 . . . . 75.44 110.947 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.62 136.1 50.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.425 . . . . 72.33 111.093 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -105.53 -26.61 11.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.449 . . . . 74.14 110.884 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -127.1 -178.59 4.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.49 . . . . 73.25 110.886 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -67.43 -25.97 66.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 71.41 110.879 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.74 -45.6 15.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 73.02 110.823 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -55.88 158.27 3.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 70.52 110.939 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tp -133.73 145.81 50.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 65.24 110.918 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -82.65 130.74 35.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 74.13 110.881 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.96 158.93 26.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 75.34 111.149 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -125.18 159.09 61.15 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.692 0.758 . . . . 62.23 110.873 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 117.78 5.29 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.698 2.265 . . . . 72.53 112.312 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.25 7.12 35.61 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.756 -0.735 . . . . 63.23 112.495 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -92.2 153.69 19.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.898 0.38 . . . . 62.13 110.872 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -94.8 123.11 38.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.158 -0.474 . . . . 75.44 110.855 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.9 mp -124.1 149.32 46.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.208 -0.451 . . . . 71.32 110.907 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.79 123.89 46.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.457 . . . . 63.41 110.889 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 31.7 mm -74.74 144.84 11.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.132 -0.485 . . . . 74.44 111.087 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 55.8 m -124.6 -35.2 2.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.134 -0.485 . . . . 64.53 110.888 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -176.03 171.9 2.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 61.33 111.088 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -124.95 173.35 8.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 75.35 110.86 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -135.39 99.55 4.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.241 -0.436 . . . . 63.22 110.906 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.8 t0 53.88 26.46 6.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.116 -0.493 . . . . 54.44 110.878 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 62.77 27.77 16.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 73.22 110.938 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -116.69 -48.24 2.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 72.24 110.9 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 70.1 m95 -114.09 145.86 41.04 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.153 -0.476 . . . . 73.24 110.942 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -121.08 139.46 53.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.258 -0.428 . . . . 75.51 110.9 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.6 mm -95.02 95.21 4.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.191 -0.459 . . . . 72.04 111.124 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -107.55 145.06 33.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 74.44 111.102 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -123.53 156.59 64.09 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.567 0.698 . . . . 75.23 110.89 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 125.71 12.45 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.672 2.248 . . . . 72.41 112.367 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 58.4 mt . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 71.45 111.131 179.945 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo . . . . . 0 C--O 1.23 0.117 0 CA-C-O 120.798 0.249 . . . . 74.31 112.351 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -116.72 -122.19 3.33 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.787 -0.721 . . . . 65.01 112.5 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -160.18 125.3 3.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.846 0.355 . . . . 75.03 110.882 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.2 p -139.98 133.29 15.23 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.609 0.719 . . . . 73.31 111.134 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.75 150.32 68.14 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.683 2.255 . . . . 75.23 112.378 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 21.6 t -58.0 -22.06 18.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 72.42 111.142 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.9 m -77.97 -2.08 35.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 50.22 110.822 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -126.1 10.19 7.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 73.14 110.912 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 2.4 t -147.21 139.73 19.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.494 . . . . 73.11 111.107 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -104.97 131.21 52.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 71.14 110.904 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 30.0 mm -87.16 108.94 18.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 73.23 111.126 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 3.1 pt -123.01 160.47 25.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 74.12 111.101 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 60.8 t0 -97.38 125.38 41.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 74.13 110.844 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mt -51.65 -37.55 50.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.476 . . . . 74.02 110.928 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.79 -31.27 35.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.141 -0.481 . . . . 73.1 110.912 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -137.69 78.32 37.22 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.606 0.717 . . . . 72.21 110.898 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 -8.12 22.8 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.641 2.227 . . . . 61.15 112.354 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.84 -33.68 11.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 52.24 111.123 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -51.8 59.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 72.3 110.87 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -90.78 18.95 5.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.436 . . . . 75.04 110.933 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -84.14 -23.06 30.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.122 -0.49 . . . . 73.22 111.11 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 47.3 t -94.6 -5.68 45.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 73.22 110.844 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 53.6 t -51.26 121.78 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.117 -0.492 . . . . 75.21 111.147 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -77.53 75.72 4.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.189 -0.46 . . . . 64.21 110.864 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -47.43 -34.16 6.91 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.446 . . . . 72.25 111.136 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -58.71 -44.47 90.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.218 -0.446 . . . . 75.22 110.898 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -69.09 113.98 6.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.104 -0.498 . . . . 73.13 110.866 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.22 -23.77 37.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 74.35 110.884 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -65.78 -54.98 19.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 74.03 110.872 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -58.67 -58.23 9.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 73.32 110.875 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -51.61 -31.68 12.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.274 -0.421 . . . . 74.23 111.171 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 9.2 mtm -68.71 -51.11 45.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.104 -0.498 . . . . 73.31 110.846 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -56.95 -43.36 81.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.447 . . . . 74.42 110.86 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.8 mp -64.43 -53.35 43.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 74.34 111.15 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 88.5 mt -59.64 -36.65 66.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 74.33 111.113 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -71.17 -52.25 20.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 75.25 110.891 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -60.77 -50.84 71.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 72.13 110.894 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -67.82 -15.07 63.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 75.21 110.9 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp 57.88 51.82 8.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 74.42 110.923 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 27.8 mt -77.94 131.5 69.91 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.658 0.742 . . . . 74.4 111.123 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 152.0 69.29 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.661 2.24 . . . . 74.33 112.352 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.73 170.24 15.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 75.0 111.188 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 95.2 t -52.01 -55.2 10.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.253 -0.43 . . . . 70.31 111.166 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -51.95 -46.42 64.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.142 -0.481 . . . . 70.34 110.868 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 58.7 mm-40 -59.68 -42.7 93.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 74.24 110.936 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 25.3 t90 -64.94 -38.26 90.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 74.44 110.925 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.86 -49.54 70.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 75.52 110.923 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -61.65 -45.44 94.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.45 . . . . 73.23 110.843 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -58.78 -51.67 68.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 74.12 110.881 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 5.5 p . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 116.156 -0.474 . . . . 73.34 111.182 -179.931 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.8 0.333 . . . . 74.55 110.902 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 22.3 mm 50.51 80.3 0.3 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.661 0.743 . . . . 73.31 111.138 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 113.49 3.39 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.668 2.245 . . . . 73.15 112.351 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -123.92 56.6 1.23 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 51.32 110.82 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -109.94 163.59 16.77 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.591 0.71 . . . . 73.21 110.873 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.84 -6.46 18.69 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.655 2.237 . . . . 74.35 112.359 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 51.47 88.13 0.12 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.554 0.692 . . . . 74.52 111.105 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.76 126.6 13.5 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.678 2.252 . . . . 61.13 112.371 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 19.2 mtmm -66.34 160.1 67.94 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.532 0.682 . . . . 75.32 110.931 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 167.32 24.76 Favored 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.719 2.279 . . . . 75.53 112.372 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 N--CA 1.466 -0.141 0 C-N-CA 122.719 2.279 . . . . 70.34 112.322 179.963 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.9 pp . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.819 0.342 . . . . 73.35 110.942 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -117.45 163.61 16.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 73.31 110.881 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -134.93 164.13 28.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 64.55 111.118 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.6 p -131.6 131.09 62.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 74.02 111.148 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.87 136.56 45.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.194 -0.457 . . . . 73.23 111.137 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 17.4 mt -108.37 -16.07 14.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 75.31 110.917 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -135.35 161.85 34.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.451 . . . . 75.43 110.909 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -84.35 105.02 14.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.085 -0.507 . . . . 73.31 110.895 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -89.61 100.24 13.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 74.45 110.912 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -80.23 106.85 12.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 75.42 110.868 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.23 152.83 16.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 75.34 111.098 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -113.73 -30.97 6.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.242 -0.435 . . . . 73.34 110.92 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.5 mmp_? -121.21 -179.85 4.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.136 -0.484 . . . . 74.21 110.906 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -64.12 -39.1 93.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.456 . . . . 75.2 110.844 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -63.11 -50.82 69.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.443 . . . . 72.33 110.865 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -55.07 135.65 48.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 72.35 110.894 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.7 tp -108.37 136.93 47.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 74.1 110.907 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -85.18 128.68 34.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 64.23 110.859 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.1 p -140.19 143.3 29.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 74.25 111.127 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -101.81 160.36 26.7 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.688 0.756 . . . . 74.04 110.836 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 121.79 8.48 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.711 2.274 . . . . 75.35 112.319 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.12 5.69 30.36 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.701 -0.761 . . . . 72.14 112.479 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -92.2 169.2 10.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.883 0.373 . . . . 72.41 110.884 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -113.51 123.33 49.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 74.14 110.836 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.4 mp -123.18 150.12 43.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.109 -0.496 . . . . 74.43 110.929 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.94 112.92 26.17 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.175 -0.466 . . . . 73.14 110.832 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 59.6 mt -76.77 145.36 10.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 75.44 111.17 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.7 m -119.51 -32.6 4.29 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.137 -0.483 . . . . 75.41 110.874 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -170.04 174.09 5.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 51.51 111.08 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -123.77 178.02 5.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 74.45 110.844 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -150.66 104.67 3.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 65.42 110.912 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 59.93 17.75 6.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.111 -0.495 . . . . 72.34 110.859 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 60.97 20.82 11.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 73.22 110.902 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -117.68 -24.42 7.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 71.43 110.912 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -132.23 135.81 46.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.107 -0.497 . . . . 75.13 110.902 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -118.08 131.99 56.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.202 -0.453 . . . . 74.54 110.877 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.4 mm -89.13 94.74 4.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 71.53 111.142 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -115.54 152.34 33.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.457 . . . . 63.44 111.085 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.0 ptpp? -122.44 157.05 60.05 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.563 0.696 . . . . 73.14 110.908 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 136.7 33.76 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.683 2.255 . . . . 75.1 112.372 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 69.1 mt . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 64.5 111.155 179.923 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.466 -0.13 0 CA-C-O 120.837 0.266 . . . . 73.44 112.321 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -129.63 -138.29 4.39 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.753 -0.737 . . . . 52.44 112.472 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -148.46 126.88 12.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.86 0.362 . . . . 75.43 110.885 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.5 p -136.8 133.45 18.85 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.597 0.713 . . . . 73.14 111.126 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 158.4 57.06 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.665 2.244 . . . . 73.42 112.349 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 6.9 t -70.09 -20.57 23.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 71.2 111.138 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.9 m -81.24 3.82 22.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 62.22 110.853 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -131.94 22.1 4.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.474 . . . . 65.32 110.918 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.8 m -152.14 160.34 3.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 74.22 111.163 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.4 ttp180 -127.62 120.56 28.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.228 -0.442 . . . . 73.05 110.89 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.6 mm -71.9 123.03 25.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 74.2 111.083 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 16.0 pt -141.86 172.07 10.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 74.35 111.143 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 48.8 t0 -119.42 129.74 54.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.466 . . . . 74.42 110.883 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.6 mt -53.57 -27.73 27.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 73.33 110.908 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.2 mmt -88.01 -31.69 19.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 75.24 110.864 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -139.44 73.7 35.73 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.596 0.712 . . . . 73.24 110.863 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 -8.58 23.97 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.731 2.288 . . . . 73.4 112.331 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -103.33 -12.8 17.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 74.44 111.091 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -75.23 -51.77 12.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.45 . . . . 72.32 110.906 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -96.77 23.13 7.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 74.24 110.943 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -85.83 -18.64 32.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 74.32 111.135 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 35.6 t -94.21 -23.42 17.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 63.11 110.904 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 7.4 p -51.29 154.83 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.119 -0.492 . . . . 74.22 111.118 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -107.89 110.24 21.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 73.13 110.853 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.65 -38.88 70.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 75.5 111.145 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -55.11 -42.16 72.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.197 -0.456 . . . . 75.03 110.925 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 52.9 t0 -63.9 105.66 0.88 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 74.14 110.924 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.01 -29.24 20.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 72.43 110.845 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -66.98 -56.17 11.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 74.12 110.862 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -59.1 -55.07 39.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 71.04 110.905 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 5.4 p -54.24 -32.7 24.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 75.03 111.138 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.3 mtm -67.3 -55.68 12.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 71.34 110.9 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.8 mttm -55.02 -38.25 67.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.438 . . . . 73.02 110.883 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 34.4 mt -65.46 -54.88 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 75.31 111.132 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 96.8 mt -61.0 -36.1 69.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.139 -0.482 . . . . 64.04 111.149 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -71.03 -47.68 57.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 74.32 110.861 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -63.03 -52.36 63.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.162 -0.472 . . . . 64.13 110.88 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -67.87 -15.8 63.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 75.12 110.866 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.6 mmtm 60.95 62.07 1.51 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.484 . . . . 75.15 110.944 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 54.7 mt -92.05 132.42 32.6 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.615 0.722 . . . . 53.43 111.144 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 169.93 17.84 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.707 2.272 . . . . 73.42 112.314 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -106.07 177.73 4.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 70.45 111.115 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.5 t -59.82 -52.79 56.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.204 -0.453 . . . . 74.35 111.118 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -54.15 -52.65 60.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 72.31 110.874 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -60.64 -38.78 85.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.156 -0.475 . . . . 74.31 110.937 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 31.2 t90 -66.45 -37.91 86.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.21 -0.45 . . . . 71.53 110.879 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.3 mmpt? -66.95 -49.38 65.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.273 -0.422 . . . . 74.42 110.899 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -61.74 -43.57 98.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 75.21 110.882 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -61.0 -52.91 63.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 73.43 110.89 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.9 p . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 75.31 111.166 -179.937 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.866 0.365 . . . . 75.34 110.895 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.6 mm 54.65 77.88 0.42 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.588 0.709 . . . . 72.31 111.155 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 87.49 0.56 Allowed 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.688 2.258 . . . . 72.33 112.294 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 33.5 t -104.01 34.17 3.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 55.43 110.859 -179.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 2.5 mtp85 -95.83 161.07 28.7 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.64 0.733 . . . . 74.03 110.852 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 111.03 2.69 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.671 2.247 . . . . 74.41 112.342 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -50.09 108.2 0.96 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.595 0.712 . . . . 73.11 111.104 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 145.69 57.6 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.73 2.287 . . . . 72.33 112.311 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -97.3 137.49 21.17 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.536 0.684 . . . . 74.11 110.903 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 165.67 30.21 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.647 2.231 . . . . 72.25 112.379 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 C--N 1.341 0.164 0 C-N-CA 122.688 2.259 . . . . 74.23 112.327 -179.998 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.827 0.346 . . . . 75.22 110.938 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -117.37 139.43 50.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 72.43 110.858 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -109.7 170.11 8.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 72.14 111.093 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.95 125.89 58.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 74.31 111.133 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.84 135.45 46.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 71.03 111.14 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 40.3 mt -105.56 -16.34 14.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.246 -0.434 . . . . 61.44 110.89 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -138.39 158.3 44.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 74.2 110.912 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -84.27 104.74 14.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.07 -0.514 . . . . 63.31 110.875 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -97.17 123.36 40.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 74.34 110.846 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.73 121.13 40.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 74.43 110.892 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.46 164.9 8.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.223 -0.444 . . . . 74.41 111.09 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -116.44 -29.49 6.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.21 -0.45 . . . . 72.12 110.899 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 -135.89 -176.18 4.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 73.2 110.828 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -63.5 -43.23 97.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 71.53 110.858 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.06 -53.15 59.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.466 . . . . 74.43 110.876 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -67.42 149.41 50.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.156 -0.474 . . . . 65.12 110.901 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.1 tp -121.17 154.16 36.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.484 . . . . 70.41 110.909 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -94.34 148.16 22.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.186 -0.461 . . . . 73.01 110.862 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -144.4 159.22 15.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 64.3 111.133 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -124.51 157.0 66.79 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.675 0.75 . . . . 74.3 110.861 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 117.68 5.23 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.726 2.284 . . . . 73.22 112.309 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.93 5.2 33.42 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.68 -0.771 . . . . 71.23 112.481 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -91.84 151.67 20.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.819 0.342 . . . . 74.24 110.905 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -100.69 113.36 26.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 72.52 110.878 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.1 mp -112.33 168.22 9.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.15 -0.477 . . . . 74.12 110.949 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.9 t -121.52 116.15 24.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.455 . . . . 71.14 110.843 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 27.9 mm -68.55 147.63 12.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 72.42 111.101 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 27.7 m -125.43 -37.05 2.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 74.14 110.875 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -170.25 171.76 6.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 61.21 111.123 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -126.44 175.45 7.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.231 -0.44 . . . . 72.23 110.844 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -147.01 102.17 3.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 74.22 110.927 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 60.9 18.18 8.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.495 . . . . 64.21 110.85 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 62.1 19.82 11.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.177 -0.465 . . . . 72.43 110.931 -179.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -119.03 -4.24 10.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.081 -0.509 . . . . 75.13 110.833 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -150.01 135.7 18.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.139 -0.482 . . . . 74.21 110.878 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -121.9 144.91 48.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 74.4 110.842 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 11.7 mm -103.51 94.88 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.483 . . . . 75.43 111.141 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -110.19 139.49 45.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 75.23 111.123 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 pttp -115.33 157.11 44.73 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.547 0.689 . . . . 75.3 110.918 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 108.39 2.07 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.664 2.242 . . . . 72.41 112.328 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 62.3 mt . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 70.03 111.156 179.888 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo . . . . . 0 N--CA 1.466 -0.1 0 CA-C-O 120.864 0.277 . . . . 64.15 112.331 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -128.85 -136.93 4.24 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.756 -0.735 . . . . 75.24 112.485 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.86 126.87 15.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.869 0.366 . . . . 65.12 110.876 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.3 p -140.53 132.8 14.4 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.617 0.722 . . . . 73.25 111.107 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 151.04 68.84 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.683 2.255 . . . . 75.55 112.37 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 15.9 t -61.97 -21.67 26.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.243 -0.435 . . . . 74.33 111.133 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.9 t -77.56 -4.11 44.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 64.14 110.856 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -122.45 15.21 10.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.123 -0.489 . . . . 73.22 110.92 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.8 m -151.42 156.33 6.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 64.45 111.084 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 -125.52 124.56 41.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 74.32 110.865 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 40.7 mm -74.72 108.98 6.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 73.01 111.143 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.1 pt -126.45 167.93 20.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 74.24 111.176 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -107.89 119.72 40.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.206 -0.452 . . . . 75.24 110.88 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.78 -30.83 15.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 70.11 110.877 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.8 mtm -81.72 -34.75 30.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 65.24 110.898 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -141.02 76.3 22.46 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.596 0.712 . . . . 75.25 110.818 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.84 -7.84 22.08 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.707 2.271 . . . . 72.32 112.303 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.77 -12.37 25.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 61.33 111.095 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.9 ttmt -84.31 -51.06 7.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.261 -0.427 . . . . 73.15 110.917 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 -94.98 23.25 5.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.175 -0.466 . . . . 73.13 110.935 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -86.57 -18.16 32.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.103 -0.498 . . . . 75.44 111.136 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 9.6 p -93.18 -16.07 25.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 71.01 110.882 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 9.9 p -51.08 144.36 2.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.118 -0.492 . . . . 72.52 111.126 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -103.78 86.5 2.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.166 -0.47 . . . . 75.41 110.844 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -51.71 -29.95 20.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 75.13 111.142 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -59.41 -47.99 83.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 75.32 110.905 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -64.05 112.22 2.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 71.41 110.856 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.66 -26.68 34.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 73.13 110.877 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -66.33 -49.59 66.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 74.11 110.921 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 3.1 mm100 -61.74 -56.07 23.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 75.51 110.931 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -55.69 -30.83 27.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 72.41 111.134 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.3 mtm -67.83 -56.89 7.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 73.35 110.876 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 44.4 mttt -57.36 -36.3 71.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 72.54 110.942 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 24.7 mt -65.72 -51.38 62.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 71.02 111.116 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 95.9 mt -61.03 -34.79 61.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.13 -0.486 . . . . 75.45 111.145 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -71.19 -47.29 58.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.476 . . . . 74.32 110.858 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -66.47 -45.68 78.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.199 -0.455 . . . . 73.22 110.927 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -73.98 -10.33 59.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.142 -0.481 . . . . 74.34 110.839 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.36 44.37 18.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.131 -0.486 . . . . 74.24 110.935 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 16.1 mt -77.25 120.3 81.0 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.597 0.713 . . . . 73.41 111.16 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.83 166.63 27.04 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.685 2.257 . . . . 72.3 112.311 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.66 169.96 10.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 74.31 111.149 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.7 t -51.42 -57.73 2.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.207 -0.451 . . . . 74.03 111.138 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -51.35 -44.27 62.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.203 -0.453 . . . . 75.23 110.887 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 71.0 mm-40 -62.19 -46.26 89.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.13 -0.486 . . . . 73.15 110.952 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -61.13 -40.13 92.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 72.24 110.951 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -64.15 -51.68 62.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 72.31 110.929 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -58.84 -39.5 81.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 74.5 110.883 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -62.7 -53.58 52.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 74.13 110.891 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.446 . . . . 74.34 111.166 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.844 0.354 . . . . 73.43 110.888 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 12.8 mm 49.1 78.35 0.41 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.577 0.703 . . . . 73.15 111.165 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 82.37 0.75 Allowed 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.692 2.261 . . . . 75.43 112.377 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -90.68 47.84 1.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 74.52 110.88 -179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.13 163.21 17.62 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.645 0.736 . . . . 72.23 110.851 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 -5.98 17.5 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.684 2.256 . . . . 74.13 112.332 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 51.22 89.4 0.1 OUTLIER Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.543 0.687 . . . . 75.13 111.094 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 129.63 17.95 Favored 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.705 2.27 . . . . 63.14 112.36 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -70.6 160.44 81.65 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.585 0.707 . . . . 74.23 110.901 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 166.39 27.79 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.693 2.262 . . . . 74.0 112.353 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--N 1.341 0.166 0 C-N-CA 122.65 2.233 . . . . 74.13 112.346 179.965 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.5 pp . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.854 0.359 . . . . 73.15 110.899 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -122.47 163.11 20.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.208 -0.451 . . . . 62.5 110.884 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -135.02 163.39 29.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 71.13 111.117 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.5 p -127.43 124.95 64.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 71.44 111.092 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.72 145.67 53.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 70.41 111.117 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.7 mt -114.46 -13.74 12.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 74.25 110.857 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -138.33 170.22 16.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 73.14 110.931 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -92.68 104.92 17.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 73.2 110.881 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -86.9 104.48 16.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 72.31 110.868 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.8 mttp -80.92 101.03 9.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.127 -0.488 . . . . 73.24 110.918 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.15 141.76 17.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 74.11 111.089 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -111.68 -28.76 7.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.203 -0.453 . . . . 71.51 110.85 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 34.0 mmt180 -127.11 -178.11 4.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 73.44 110.854 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -66.95 -37.33 84.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 74.21 110.888 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -67.91 -30.23 69.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 70.3 110.856 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -81.6 135.03 35.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 71.54 110.883 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.9 tp -108.11 150.12 27.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.127 -0.488 . . . . 73.33 110.921 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -91.73 123.26 34.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 70.41 110.868 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.2 p -133.09 156.63 42.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.201 -0.454 . . . . 73.41 111.095 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.93 158.55 40.41 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.709 0.766 . . . . 74.41 110.808 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 118.71 5.85 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.71 2.273 . . . . 70.12 112.341 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.04 -1.41 38.21 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.721 -0.752 . . . . 74.51 112.485 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -83.83 162.24 20.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.828 0.347 . . . . 75.24 110.92 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -100.76 132.32 46.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 75.42 110.847 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.2 mt -129.47 151.71 49.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.106 -0.497 . . . . 74.12 110.902 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.69 112.82 25.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 74.32 110.908 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 56.3 mt -80.67 144.44 10.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.141 -0.481 . . . . 75.41 111.139 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.5 m -117.11 -39.96 3.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.193 -0.458 . . . . 52.14 110.856 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -163.28 173.76 12.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.202 -0.454 . . . . 72.23 111.056 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -119.97 177.96 4.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 74.41 110.819 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -148.2 101.17 3.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 71.14 110.912 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 60.15 18.05 7.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 53.54 110.862 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 61.61 20.62 11.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.23 -0.441 . . . . 75.02 110.925 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -118.25 -9.33 10.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.11 -0.496 . . . . 53.14 110.879 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -149.23 135.81 19.44 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.15 -0.477 . . . . 74.33 110.944 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -116.45 130.23 56.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.237 -0.438 . . . . 75.15 110.907 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.7 mm -83.54 95.1 3.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 72.32 111.136 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -110.87 149.61 30.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 75.3 111.114 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 pttp -125.04 157.22 67.7 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.555 0.693 . . . . 75.21 110.935 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 135.97 31.7 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.642 2.228 . . . . 74.44 112.335 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 57.2 mt . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 72.13 111.167 179.896 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 N--CA 1.466 -0.109 0 CA-C-O 120.863 0.276 . . . . 63.33 112.318 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.5 -141.93 4.55 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.705 -0.76 . . . . 73.12 112.485 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -146.24 131.26 18.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.828 0.347 . . . . 74.41 110.939 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.5 p -142.41 133.58 12.93 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.606 0.717 . . . . 72.34 111.196 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 152.69 69.39 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.649 2.233 . . . . 74.11 112.309 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 13.1 t -64.85 -21.75 30.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.467 . . . . 70.11 111.145 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.4 t -77.09 -3.07 37.37 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.474 . . . . 74.34 110.863 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -125.09 18.22 8.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 72.31 110.878 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 13.6 m -148.96 159.86 5.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 72.54 111.077 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 18.4 ttm180 -127.28 112.31 14.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 75.44 110.894 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 35.2 mm -64.66 114.14 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.459 . . . . 73.52 111.11 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.5 pt -133.52 137.69 52.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 74.14 111.177 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -75.13 122.23 23.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.163 -0.471 . . . . 75.44 110.877 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.4 mt -52.02 -32.79 35.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 75.31 110.93 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 8.5 mmt -83.06 -29.16 29.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.474 . . . . 75.5 110.845 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -145.3 78.95 11.91 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 121.618 0.723 . . . . 75.03 110.905 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 -7.73 21.82 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.678 2.252 . . . . 73.11 112.306 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.15 -7.89 37.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.258 -0.428 . . . . 74.43 111.123 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.4 mtpt -84.12 -52.11 6.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 74.55 110.9 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -97.64 23.73 7.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.204 -0.453 . . . . 74.32 110.941 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -84.88 -17.06 39.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.088 -0.505 . . . . 62.25 111.053 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 38.0 m -97.87 -18.36 18.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 61.23 110.856 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 7.3 p -51.2 144.84 2.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.105 -0.498 . . . . 75.11 111.127 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -99.14 87.28 3.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.133 -0.485 . . . . 74.22 110.908 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.92 -34.62 42.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.452 . . . . 73.22 111.203 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -58.22 -45.02 88.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 75.13 110.937 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -63.5 109.14 1.54 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.115 -0.493 . . . . 73.52 110.921 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.61 -26.24 31.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 73.05 110.868 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -67.01 -52.85 37.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 73.13 110.895 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -60.99 -56.42 21.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 72.41 110.931 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 1.5 p -53.7 -31.49 20.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.464 . . . . 73.3 111.135 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 12.3 mtm -68.06 -56.54 8.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.461 . . . . 75.42 110.86 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.1 mttt -55.05 -37.42 66.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.19 -0.459 . . . . 75.42 110.891 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 48.0 mt -66.32 -52.67 44.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.431 . . . . 73.41 111.157 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 96.5 mt -61.96 -35.8 70.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 72.53 111.133 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -69.9 -47.66 61.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.139 -0.482 . . . . 61.23 110.853 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -64.25 -49.25 72.65 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 75.54 110.883 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -68.04 -14.71 63.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 73.33 110.907 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.5 mmtp 60.46 55.81 3.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 73.23 110.941 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 31.4 mt -88.41 126.09 61.45 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.623 0.725 . . . . 72.01 111.159 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 163.8 36.9 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.709 2.273 . . . . 72.12 112.361 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.95 172.11 8.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 73.24 111.132 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 88.2 t -51.34 -54.31 12.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.451 . . . . 74.32 111.117 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -50.5 -47.5 57.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 73.35 110.888 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 45.4 mm-40 -62.96 -41.89 99.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.096 -0.502 . . . . 72.12 110.899 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 24.2 t90 -65.19 -39.99 93.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.2 -0.454 . . . . 74.23 110.94 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.82 -49.54 70.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.276 -0.42 . . . . 74.43 110.916 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -63.16 -37.73 88.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 74.25 110.89 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -63.49 -52.04 63.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 73.24 110.915 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.171 -0.468 . . . . 74.33 111.117 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.848 0.356 . . . . 65.52 110.87 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 58.1 mt 45.46 84.47 0.19 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.638 0.732 . . . . 75.54 111.099 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 127.51 14.67 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.666 2.244 . . . . 64.21 112.339 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -114.03 0.73 14.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.239 -0.437 . . . . 75.51 110.874 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -50.63 163.82 0.45 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.635 0.731 . . . . 64.13 110.849 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -16.22 37.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.651 2.234 . . . . 73.54 112.377 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.1 84.65 0.18 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.549 0.69 . . . . 70.33 111.12 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 138.02 36.94 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.679 2.253 . . . . 65.42 112.351 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -71.4 160.69 81.81 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.572 0.701 . . . . 73.31 110.895 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 167.6 24.0 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.635 2.223 . . . . 64.55 112.33 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 C--N 1.342 0.192 0 C-N-CA 122.66 2.24 . . . . 70.33 112.382 179.934 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.861 0.362 . . . . 75.13 110.907 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -129.8 161.49 30.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 72.41 110.874 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -136.39 161.64 35.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 73.34 111.09 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.7 p -130.76 128.07 62.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.466 . . . . 75.11 111.104 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.32 139.63 44.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.173 -0.467 . . . . 73.2 111.153 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.9 mt -114.9 -15.4 11.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 75.0 110.866 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -135.07 158.2 44.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 74.34 110.918 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -84.38 105.14 14.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.088 -0.506 . . . . 74.4 110.878 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -88.31 117.98 27.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 72.24 110.915 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.7 mttt -93.47 113.18 25.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 73.12 110.845 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.36 156.71 33.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 73.51 111.099 179.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -115.66 -28.55 6.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 73.1 110.867 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.6 mmm180 -133.09 174.55 10.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 74.53 110.856 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -58.85 -40.99 85.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 73.33 110.877 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -60.32 -25.89 66.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.172 -0.467 . . . . 71.31 110.871 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -87.62 139.41 30.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.452 . . . . 74.2 110.908 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tp -116.11 123.27 47.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.182 -0.463 . . . . 70.31 110.913 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -74.26 145.73 43.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.184 -0.462 . . . . 71.14 110.874 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.9 p -147.35 156.78 10.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.232 -0.44 . . . . 72.33 111.136 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -113.2 158.45 38.11 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.649 0.738 . . . . 74.35 110.855 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 125.32 12.02 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.681 2.254 . . . . 62.52 112.358 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.16 -6.84 32.49 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.717 -0.754 . . . . 71.4 112.496 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -87.74 143.99 26.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.855 0.36 . . . . 71.13 110.882 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -97.07 120.56 37.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 65.32 110.915 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 mp -111.89 157.44 20.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 72.22 110.873 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.33 112.85 25.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 74.41 110.836 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 29.7 mm -69.68 143.5 14.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 73.42 111.097 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.5 m -121.4 -39.7 2.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.15 -0.477 . . . . 74.22 110.925 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -173.89 173.43 3.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.474 . . . . 72.01 111.105 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -120.87 176.19 5.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 63.41 110.876 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' TYR . . . . . 0.413 ' HB3' ' HB2' ' A' ' 36' ' ' TRP . 29.7 t80 -146.59 101.01 3.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.198 -0.455 . . . . 74.51 110.941 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ASP . . . . . 0.427 ' HB3' ' CG ' ' A' ' 35' ' ' GLU . 38.0 t0 61.44 16.45 7.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 71.3 110.903 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 63.76 30.06 14.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 72.14 110.908 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.427 ' CG ' ' HB3' ' A' ' 33' ' ' ASP . 3.6 pt-20 -132.21 -1.57 3.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.158 -0.474 . . . . 72.44 110.906 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.413 ' HB2' ' HB3' ' A' ' 32' ' ' TYR . 85.5 m95 -152.75 135.46 15.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.155 -0.475 . . . . 74.42 110.938 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -121.72 139.0 54.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.289 -0.414 . . . . 72.21 110.886 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 12.9 mm -93.31 94.79 4.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.126 -0.488 . . . . 75.53 111.131 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -108.75 134.87 50.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.466 . . . . 75.22 111.135 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.64 156.53 39.52 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.555 0.693 . . . . 74.3 110.914 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 124.17 10.84 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.691 2.261 . . . . 75.24 112.33 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 46.8 mt . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.276 -0.42 . . . . 71.32 111.102 179.906 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.466 -0.12 0 CA-C-O 120.823 0.259 . . . . 72.45 112.312 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.22 -158.01 8.38 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.752 -0.737 . . . . 64.43 112.55 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -124.92 125.01 43.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.89 0.376 . . . . 71.21 110.915 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.4 p -131.11 133.74 25.03 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-O 121.626 0.727 . . . . 71.2 111.12 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 153.19 69.36 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.669 2.246 . . . . 72.44 112.365 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.6 t -74.39 -21.14 17.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 71.35 111.151 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.9 m -76.59 -3.28 36.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 74.42 110.852 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -125.97 21.29 7.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.148 -0.478 . . . . 74.04 110.946 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 10.4 m -148.87 167.0 3.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.086 -0.506 . . . . 61.3 111.146 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 39.8 ttm-85 -138.35 119.68 14.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 73.25 110.811 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 38.8 mm -70.29 108.8 2.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.183 -0.462 . . . . 64.41 111.154 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 2.2 pt -128.31 140.3 49.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.459 . . . . 75.55 111.122 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -78.76 121.91 25.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.187 -0.46 . . . . 74.53 110.848 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.5 -30.02 39.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.157 -0.474 . . . . 74.3 110.892 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 14.3 mmt -85.36 -26.07 26.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 73.44 110.865 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -148.95 77.72 9.14 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.665 0.745 . . . . 71.33 110.884 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 -7.95 22.35 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.696 2.264 . . . . 72.2 112.376 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.42 -5.98 45.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.203 -0.453 . . . . 71.31 111.15 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -84.03 -41.49 17.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 65.42 110.867 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -111.72 23.67 13.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.213 -0.449 . . . . 73.2 110.957 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -81.34 -13.4 58.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.09 -0.505 . . . . 73.23 111.13 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.4 t -102.85 -22.22 13.91 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 64.15 110.825 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 9.9 p -51.18 156.61 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.108 -0.496 . . . . 73.25 111.097 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -114.25 107.43 15.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 65.53 110.867 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.8 -25.8 63.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.153 -0.476 . . . . 72.14 111.145 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -62.97 -47.67 82.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.225 -0.443 . . . . 72.33 110.918 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -63.83 110.16 1.99 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.136 -0.484 . . . . 65.3 110.87 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.31 -27.61 24.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 73.25 110.855 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -66.96 -54.36 22.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.445 . . . . 75.12 110.87 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -59.77 -55.75 30.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 74.34 110.878 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 5.4 p -54.05 -32.81 23.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.209 -0.451 . . . . 72.43 111.168 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 15.0 mtm -67.15 -53.83 26.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.128 -0.487 . . . . 74.31 110.872 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.0 mttm -56.52 -38.37 71.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 74.21 110.891 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 16.5 mt -65.29 -52.95 45.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.456 . . . . 65.32 111.088 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 94.7 mt -62.01 -36.48 74.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 74.13 111.151 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -70.19 -46.78 63.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.147 -0.479 . . . . 72.31 110.804 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -63.53 -53.64 48.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 71.42 110.878 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.2 m-85 -68.03 -14.8 63.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.132 -0.486 . . . . 75.13 110.85 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 28.6 mmtm 60.78 55.49 3.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 75.43 110.93 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 36.0 mt -82.5 131.98 53.72 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.601 0.715 . . . . 74.23 111.193 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 166.94 25.93 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.665 2.244 . . . . 74.32 112.316 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -97.33 168.01 10.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 73.31 111.154 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.2 t -51.41 -54.91 9.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 74.52 111.129 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -51.65 -52.06 50.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 74.12 110.846 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -57.02 -42.44 80.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 73.2 110.898 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -62.2 -39.39 92.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.218 -0.446 . . . . 74.33 110.932 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -65.12 -53.37 46.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.223 -0.444 . . . . 75.15 110.868 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -59.06 -37.23 76.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 43.41 110.872 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -64.4 -54.42 33.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 75.32 110.94 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.208 -0.451 . . . . 70.53 111.171 -179.945 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.845 0.355 . . . . 74.02 110.886 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 3.9 mp 51.67 82.02 0.25 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.579 0.704 . . . . 71.25 111.163 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.71 117.88 5.35 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.649 2.232 . . . . 74.14 112.388 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 30.5 t -107.02 5.06 27.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.246 -0.433 . . . . 74.34 110.84 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 2.0 mpp_? -51.62 162.72 0.69 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.567 0.698 . . . . 75.12 110.888 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 -11.19 30.31 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.642 2.228 . . . . 73.02 112.32 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 63.82 82.3 0.21 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.611 0.719 . . . . 73.31 111.083 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 141.18 44.47 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.663 2.242 . . . . 73.24 112.332 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 22.1 mtmm -86.81 159.61 51.66 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.578 0.704 . . . . 71.45 110.89 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 166.9 26.04 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.658 2.239 . . . . 74.43 112.383 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--N 1.342 0.197 0 C-N-CA 122.696 2.264 . . . . 73.45 112.343 179.974 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 1.1 ptt? . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.797 0.332 . . . . 74.11 110.87 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -97.79 160.22 29.07 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.619 0.723 . . . . 65.13 111.079 179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.7 79.31 0.93 Allowed 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 122.675 2.25 . . . . 62.2 112.372 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.7 156.16 32.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.451 . . . . 74.15 110.926 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -133.22 146.11 51.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 73.41 110.949 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -122.56 153.47 39.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.187 -0.46 . . . . 64.12 111.103 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.5 p -123.27 130.22 74.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.21 -0.45 . . . . 70.33 111.118 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.26 138.17 47.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 62.24 111.182 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 13.4 mt -112.44 -12.02 13.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.254 -0.43 . . . . 74.23 110.95 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -137.69 154.81 49.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.185 -0.461 . . . . 75.41 110.931 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -81.94 104.73 12.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.127 -0.488 . . . . 71.41 110.893 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -109.61 102.87 11.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 73.31 110.845 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -78.99 136.32 37.18 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 75.22 110.88 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.32 161.2 11.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 63.13 111.102 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -124.6 -36.47 2.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 74.0 110.936 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -132.45 -177.88 4.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 74.41 110.886 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -65.67 -15.12 62.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.221 -0.445 . . . . 74.0 110.886 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -99.03 22.34 10.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 73.1 110.878 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.0 mp0 -136.87 142.85 42.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 74.42 110.843 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.5 tp -121.36 126.45 49.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.145 -0.48 . . . . 75.04 110.946 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -65.5 139.96 58.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.457 . . . . 73.44 110.83 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -142.47 158.44 19.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 74.53 111.17 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -127.17 159.85 62.87 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.649 0.738 . . . . 61.31 110.83 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 117.78 5.29 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.659 2.239 . . . . 72.24 112.373 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.5 7.12 30.47 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.718 -0.753 . . . . 44.45 112.448 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 22.2 mm-40 -91.91 162.49 14.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.857 0.36 . . . . 74.13 110.908 -179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -107.96 119.42 39.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 74.04 110.897 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.5 mt -120.98 154.29 36.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.195 -0.457 . . . . 75.22 110.946 179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -109.03 115.94 31.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 72.33 110.844 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 35.4 mm -70.57 143.32 14.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.476 . . . . 73.43 111.149 179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.9 m -124.5 -37.13 2.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 71.23 110.887 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -168.87 170.62 9.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 73.53 111.093 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -123.89 174.51 7.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 73.34 110.873 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -142.16 100.68 3.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 75.24 110.896 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 60.09 18.78 8.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.075 -0.511 . . . . 63.44 110.87 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 36.4 m-85 65.45 23.95 11.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.218 -0.446 . . . . 75.15 110.942 -179.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.417 ' HB2' ' CD1' ' A' ' 36' ' ' TRP . 0.4 OUTLIER -116.92 -41.31 3.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.098 -0.501 . . . . 74.3 110.866 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.417 ' CD1' ' HB2' ' A' ' 35' ' ' GLU . 56.6 m95 -116.62 140.32 49.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.185 -0.461 . . . . 74.44 110.926 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -119.31 142.8 47.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 74.21 110.873 -179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 23.5 mm -96.27 95.44 4.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 74.55 111.103 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -109.06 136.38 48.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 60.41 111.099 179.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.8 pttt -111.46 157.73 38.31 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.621 0.724 . . . . 74.33 110.908 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 135.53 30.58 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.701 2.268 . . . . 73.2 112.367 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 79.3 mt -108.11 -39.36 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.26 -0.427 . . . . 75.52 111.152 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' A ASN . . . . . . . . . . . . . 9.4 m-80 -72.82 -69.1 0.43 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 73.01 110.922 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' B ARG . . . . . . . . . . . . . 16.7 ptt85 -80.05 178.79 7.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 71.4 110.863 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 12.1 mt -125.36 121.47 34.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 74.51 110.865 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -157.2 -71.62 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.688 -0.768 . . . . 71.34 112.477 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 167.76 165.32 24.96 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.752 -0.737 . . . . 54.11 112.486 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.83 147.63 62.84 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.642 2.228 . . . . 73.3 112.327 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.22 -143.29 4.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.771 -0.728 . . . . 70.44 112.504 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -146.17 124.86 12.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.893 0.378 . . . . 73.23 110.899 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.3 p -136.18 133.87 19.82 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.635 0.731 . . . . 74.22 111.14 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 153.18 69.22 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.664 2.243 . . . . 72.24 112.352 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 11.1 t -66.34 -21.74 29.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.245 -0.434 . . . . 75.15 111.164 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.1 m -77.94 -1.93 34.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.154 -0.475 . . . . 72.31 110.871 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -126.84 22.91 6.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.137 -0.483 . . . . 73.11 110.934 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.8 m -150.23 165.18 3.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.1 -0.5 . . . . 74.51 111.181 179.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 40.0 ttp85 -133.5 114.02 13.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.233 -0.44 . . . . 74.51 110.865 -179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 29.1 mm -69.37 127.34 31.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 74.32 111.129 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 24.7 pt -143.49 -178.22 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 73.41 111.132 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -131.44 132.67 44.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.467 . . . . 62.12 110.838 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 57.6 mt -59.28 -21.84 60.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 73.43 110.974 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.1 mtm -90.04 -30.21 17.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.14 -0.482 . . . . 74.22 110.903 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -152.19 75.69 7.27 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.584 0.707 . . . . 74.45 110.855 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.82 -11.12 30.11 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.64 2.226 . . . . 74.1 112.308 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.07 -5.56 47.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.241 -0.436 . . . . 65.22 111.107 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.3 ttmm -83.06 -51.12 7.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 73.4 110.916 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -99.76 23.23 9.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.232 -0.44 . . . . 64.34 110.921 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -87.03 -20.88 26.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.484 . . . . 72.44 111.118 179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.0 t -92.85 -21.06 20.09 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.2 -0.455 . . . . 72.43 110.865 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 7.6 p -51.55 152.27 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.495 . . . . 75.11 111.151 179.917 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -104.18 91.33 3.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 60.23 110.903 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -51.6 -35.66 42.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 75.3 111.136 -179.864 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -58.02 -43.98 87.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.221 -0.445 . . . . 72.0 110.969 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -63.83 107.98 1.35 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.094 -0.503 . . . . 62.12 110.846 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.28 -28.46 19.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 75.54 110.851 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -66.73 -55.0 17.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 63.24 110.896 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -59.58 -56.35 23.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 74.21 110.891 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 4.2 p -53.44 -32.34 20.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 75.32 111.152 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 9.8 mtm -67.41 -54.51 19.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 73.53 110.879 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.83 -37.91 69.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.263 -0.426 . . . . 75.54 110.863 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 84.4 mt -66.12 -53.46 36.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 72.33 111.155 179.855 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 96.4 mt -61.86 -36.21 72.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.459 . . . . 74.2 111.124 179.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 61.1 t0 -71.05 -48.26 53.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 71.35 110.864 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -60.88 -53.89 51.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 74.44 110.896 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -69.21 -11.96 61.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.475 . . . . 74.42 110.9 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt 58.45 54.53 5.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 74.25 110.872 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 20.5 mt -81.06 131.61 59.08 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.638 0.733 . . . . 73.31 111.094 179.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 159.04 54.84 Favored 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.675 2.25 . . . . 64.11 112.384 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -92.84 170.0 10.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 75.21 111.188 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 98.4 t -52.04 -58.07 2.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.28 -0.418 . . . . 71.52 111.074 179.951 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -51.54 -51.86 51.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.451 . . . . 73.35 110.881 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 51.5 mm-40 -57.23 -38.56 73.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.136 -0.484 . . . . 71.3 110.971 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 24.2 t90 -66.39 -43.3 86.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.169 -0.469 . . . . 75.12 110.929 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -61.54 -47.92 83.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 73.32 110.927 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -64.69 -39.93 94.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.436 . . . . 74.42 110.886 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -60.39 -49.24 78.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.454 . . . . 74.43 110.94 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -66.07 -41.84 90.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.444 . . . . 75.04 111.121 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -59.81 -48.62 80.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 73.51 110.865 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 12.2 ptp180 -72.11 -32.63 67.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 73.54 110.848 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -67.65 -33.93 75.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 71.01 110.904 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 12.6 mmmt -73.82 -25.65 60.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.137 -0.483 . . . . 73.31 110.938 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -63.43 179.24 0.46 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 70.02 110.881 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 24.2 m -87.15 120.73 28.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 73.22 110.864 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 51.7 p -165.29 -174.53 3.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.126 -0.488 . . . . 73.22 110.843 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 23.4 mm -67.23 150.25 11.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.133 -0.485 . . . . 71.54 111.137 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -173.96 -178.83 1.59 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 75.02 110.899 179.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 28.7 mm -127.09 127.24 69.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 71.53 111.149 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -71.95 -34.12 62.21 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.715 -0.755 . . . . 64.1 112.48 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -59.71 139.68 57.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.887 0.375 . . . . 74.53 110.882 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 131.98 124.12 2.53 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.754 -0.736 . . . . 32.23 112.507 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -139.99 133.42 30.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.798 0.332 . . . . 74.42 110.875 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -131.44 154.57 20.94 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.672 -0.775 . . . . 51.51 112.477 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -148.68 171.73 15.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.811 0.338 . . . . 74.12 110.932 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 74.1 m -106.39 144.14 33.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 73.44 110.825 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 74.3 mm-40 -65.03 177.26 1.03 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.123 -0.49 . . . . 73.54 110.899 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -176.52 109.37 0.28 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.769 -0.729 . . . . 75.41 112.512 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 27.9 mt -130.34 162.83 28.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.75 0.31 . . . . 75.45 110.944 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 74.33 110.885 179.91 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 N-CA-C 112.498 -0.241 . . . . 73.33 112.498 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 63.89 26.99 14.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.801 0.334 . . . . 75.4 110.913 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 38.8 m-85 -137.45 56.82 1.76 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 75.43 110.891 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 26.7 mm -110.82 81.64 2.65 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.631 0.729 . . . . 71.53 111.087 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 78.46 1.0 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.667 2.245 . . . . 75.2 112.333 179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 29.7 m -82.5 0.31 43.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.254 -0.43 . . . . 71.4 110.857 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 2.1 mpp_? -67.63 162.17 59.57 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.552 0.692 . . . . 74.23 110.864 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 158.88 55.48 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.651 2.234 . . . . 61.32 112.411 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -91.37 111.94 51.51 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.55 0.69 . . . . 75.24 111.101 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 149.84 67.23 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.65 2.233 . . . . 72.4 112.355 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 17.0 mtmt -99.89 161.18 25.18 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.598 0.713 . . . . 74.44 110.913 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 168.25 22.07 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.7 2.267 . . . . 75.22 112.336 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 87.82 0.55 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.627 2.218 . . . . 71.14 112.368 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 26.2 p -153.85 157.82 39.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 73.33 110.882 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 55.9 m -83.87 97.92 9.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 75.42 110.88 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.097 -0.501 . . . . 75.04 111.096 179.944 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 7.4 ptm . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.804 0.335 . . . . 72.33 110.85 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -131.8 156.22 80.39 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.573 0.702 . . . . 72.44 111.092 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 77.46 1.06 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.681 2.254 . . . . 74.23 112.34 179.993 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -72.94 145.03 47.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.247 -0.433 . . . . 75.22 110.917 179.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 63.8 m-85 -115.26 153.68 30.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.178 -0.464 . . . . 65.12 110.892 179.914 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -129.47 152.88 48.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 72.03 111.14 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 p -120.49 125.65 74.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.261 -0.427 . . . . 75.14 111.127 179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -66.95 131.39 45.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 75.05 111.105 -179.936 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 71.3 mt -102.36 -17.87 15.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 75.44 110.918 179.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -133.96 157.14 46.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 75.54 110.963 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -82.55 105.28 13.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 74.21 110.878 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -84.64 105.05 15.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.117 -0.492 . . . . 72.42 110.88 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.5 mttp -81.22 97.82 7.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 74.14 110.871 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.36 140.35 22.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 54.51 111.106 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -107.06 -28.86 9.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 63.34 110.89 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -129.77 -179.25 5.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.466 . . . . 75.23 110.868 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -65.02 -36.9 85.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 75.01 110.859 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -63.25 -34.91 78.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.167 -0.47 . . . . 70.14 110.88 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -77.16 140.7 40.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.179 -0.464 . . . . 72.13 110.922 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 12.3 tp -112.54 127.2 56.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.155 -0.475 . . . . 74.05 110.937 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 -72.89 125.22 27.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.247 -0.433 . . . . 74.32 110.838 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 10.1 p -138.78 152.65 24.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 74.23 111.106 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -114.41 159.64 35.98 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.673 0.749 . . . . 74.34 110.859 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 123.18 9.83 Favored 'Trans proline' 0 C--N 1.341 0.143 0 C-N-CA 122.672 2.248 . . . . 73.13 112.346 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.09 4.53 31.12 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.696 -0.764 . . . . 62.21 112.47 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -92.01 165.1 13.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.842 0.353 . . . . 73.41 110.91 -179.902 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.9 m120 -110.75 128.37 55.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.151 -0.477 . . . . 74.02 110.915 -179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.1 mt -128.24 146.48 50.72 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.188 -0.46 . . . . 74.32 110.902 179.992 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.25 123.26 39.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 74.22 110.891 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 34.3 mm -70.12 144.49 13.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.468 . . . . 63.42 111.146 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 21.8 m -125.77 -37.48 2.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 74.33 110.879 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -179.11 171.54 1.34 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 71.01 111.121 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -124.25 176.85 6.16 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 71.44 110.876 -179.985 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.5 t80 -148.03 102.78 3.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 73.31 110.942 -179.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 60.16 18.64 8.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.139 -0.482 . . . . 74.54 110.883 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 44.2 m-85 61.79 20.23 11.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 75.3 110.922 -179.836 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -119.47 -3.81 10.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.113 -0.494 . . . . 72.13 110.863 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 90.5 m95 -151.57 135.8 16.74 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.148 -0.478 . . . . 75.01 110.893 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -120.06 145.64 46.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.231 -0.44 . . . . 70.44 110.887 179.959 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.8 mm -100.83 95.12 3.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.122 -0.49 . . . . 75.14 111.119 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -110.18 134.91 51.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.469 . . . . 73.12 111.107 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.8 pttt -111.34 156.75 40.68 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.59 0.71 . . . . 74.11 110.885 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 115.44 4.1 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.722 2.281 . . . . 74.4 112.313 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 55.1 mt -72.35 -34.72 49.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 73.21 111.142 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' A ASN . . . . . . . . . . . . . 8.5 t30 -89.22 -57.01 3.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.148 -0.478 . . . . 74.43 110.886 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' B ARG . . . . . . . . . . . . . 27.8 mtm-85 -67.55 149.01 50.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 74.42 110.86 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.07 12.42 32.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.181 -0.463 . . . . 74.13 110.927 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -51.79 -86.37 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.737 -0.744 . . . . 72.43 112.462 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -179.46 165.71 34.59 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.773 -0.727 . . . . 63.51 112.502 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 146.07 58.89 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.658 2.239 . . . . 71.13 112.31 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -133.68 -156.8 8.09 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.744 -0.741 . . . . 41.23 112.496 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.7 tt -131.11 124.86 31.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.797 0.332 . . . . 72.54 110.953 -179.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.3 p -137.23 133.46 18.37 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.613 0.72 . . . . 72.45 111.13 179.85 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 155.63 65.46 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.644 2.23 . . . . 72.22 112.341 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 9.4 t -68.39 -21.44 26.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.45 . . . . 74.43 111.134 179.913 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -77.24 -3.06 37.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.152 -0.476 . . . . 72.02 110.837 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -124.89 19.91 8.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.131 -0.486 . . . . 73.23 110.882 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.0 m -150.24 157.41 6.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.111 -0.495 . . . . 54.54 111.094 179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 22.4 ttp180 -123.93 110.77 15.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 73.21 110.853 -179.97 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 38.9 mm -64.69 121.37 13.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 74.02 111.135 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 14.8 pt -136.18 173.41 13.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.172 -0.467 . . . . 74.3 111.16 179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -115.92 126.33 53.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 74.51 110.839 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -52.49 -29.34 24.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 74.31 110.95 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.82 -26.01 19.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.216 -0.447 . . . . 73.42 110.9 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -141.61 73.76 23.91 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.611 0.72 . . . . 74.43 110.878 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.77 -8.97 24.97 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.691 2.26 . . . . 72.22 112.387 -179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -102.67 -17.61 15.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 74.33 111.116 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.9 ttmm -73.44 -51.9 15.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 73.11 110.918 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -95.43 23.03 6.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 75.12 110.948 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -86.99 -19.96 27.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.118 -0.492 . . . . 73.22 111.075 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 8.2 p -88.67 -19.92 25.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 75.54 110.822 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 7.0 p -51.53 148.28 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 73.51 111.125 179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -105.82 89.44 3.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 75.15 110.862 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -51.32 -30.38 18.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 74.1 111.169 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -61.25 -48.5 81.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.187 -0.46 . . . . 65.01 110.909 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.85 112.57 2.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.159 -0.473 . . . . 75.11 110.877 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.42 -24.64 31.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.155 -0.475 . . . . 65.01 110.887 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -66.9 -54.01 26.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 74.44 110.885 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -59.83 -57.89 10.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 73.45 110.876 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 2.0 p -51.88 -32.21 14.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 74.52 111.144 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 9.9 mtm -68.11 -53.22 26.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 74.5 110.855 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.9 mttm -55.75 -38.14 69.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 73.14 110.884 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 30.0 mt -66.65 -55.63 17.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 72.1 111.154 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 93.0 mt -59.98 -36.78 69.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 52.54 111.137 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -71.22 -52.08 21.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 71.42 110.854 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -60.21 -51.16 70.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.161 -0.472 . . . . 72.52 110.876 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -70.03 -11.16 60.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 70.11 110.86 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 26.9 mmtt 58.12 49.19 11.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 75.12 110.856 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 14.2 mt -78.28 125.74 84.43 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.607 0.718 . . . . 73.14 111.13 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 158.3 57.43 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.682 2.255 . . . . 64.01 112.325 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.41 172.23 9.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 62.21 111.149 -179.993 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.9 t -52.28 -51.69 30.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 74.23 111.111 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -51.6 -51.97 51.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 73.44 110.859 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 43.0 mm-40 -58.13 -40.77 82.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 72.4 110.956 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 23.6 t90 -64.89 -40.5 95.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 74.42 110.945 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.69 -52.45 60.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.233 -0.439 . . . . 73.4 110.88 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -59.18 -43.97 92.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 74.13 110.849 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -59.38 -48.81 80.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.462 . . . . 72.41 110.873 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.2 p -66.28 -38.75 88.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.23 -0.441 . . . . 72.03 111.142 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 12.2 mtm180 -60.75 -57.33 13.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 73.01 110.876 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 46.5 mtp180 -62.66 -39.09 92.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 73.31 110.852 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -59.44 -43.74 93.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.161 -0.472 . . . . 72.15 110.938 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 13.6 mmtp -79.82 -25.46 40.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.097 -0.501 . . . . 72.31 110.91 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -79.88 -177.46 5.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 72.04 110.921 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.7 t 62.72 38.29 12.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 74.54 110.848 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 89.6 p -82.63 -169.39 2.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.128 -0.487 . . . . 62.32 110.856 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 10.0 mt -79.59 158.59 4.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.085 -0.507 . . . . 72.24 111.146 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -48.96 164.92 0.06 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.175 -0.466 . . . . 75.24 110.921 179.91 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 23.2 mm -118.7 151.11 20.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 74.13 111.124 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -100.67 -138.8 10.43 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.77 -0.728 . . . . 73.31 112.532 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -77.31 128.46 34.34 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.914 0.388 . . . . 70.54 110.881 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -129.43 -72.11 0.13 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.707 -0.758 . . . . 71.3 112.462 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 -58.79 99.64 0.05 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.865 0.364 . . . . 74.51 110.873 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -85.12 -74.69 1.25 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.786 -0.721 . . . . 73.52 112.46 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -162.74 121.03 2.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.798 0.332 . . . . 60.14 110.913 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 44.9 m -86.59 171.96 10.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 73.04 110.857 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -106.78 -26.65 11.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.12 -0.491 . . . . 72.42 110.916 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 67.58 59.49 6.62 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.766 -0.731 . . . . 70.4 112.47 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 82.0 mt -118.8 -46.98 2.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.825 0.345 . . . . 73.51 110.911 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 75.04 110.902 179.941 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.336 0 N-CA-C 112.475 -0.25 . . . . 74.31 112.475 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.67 -30.41 32.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.769 0.319 . . . . 73.51 110.9 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 66.9 m-85 -75.21 -75.0 0.18 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.266 -0.425 . . . . 74.45 110.887 179.934 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.3 mm 51.81 77.08 0.48 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.57 0.7 . . . . 74.51 111.127 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 92.36 0.51 Allowed 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.654 2.236 . . . . 74.15 112.368 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 29.1 t -89.44 3.54 51.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 74.51 110.861 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.47 162.17 0.72 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.623 0.725 . . . . 74.02 110.861 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -16.16 37.65 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.653 2.236 . . . . 54.34 112.354 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.3 80.56 0.23 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.617 0.723 . . . . 70.41 111.113 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 154.1 68.1 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.691 2.261 . . . . 71.44 112.335 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -93.51 159.54 34.81 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.555 0.693 . . . . 73.11 110.87 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 166.8 26.41 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.685 2.256 . . . . 75.2 112.315 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 -27.49 26.56 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.731 2.287 . . . . 75.12 112.332 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 47.5 t -104.23 97.54 7.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 74.33 110.894 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 22.4 p -101.77 147.26 26.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 64.5 110.908 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.459 . . . . 70.52 111.119 179.9 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 16.7 ptm . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.82 0.343 . . . . 73.15 110.87 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -109.96 160.33 28.51 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.59 0.71 . . . . 52.43 111.087 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.79 95.43 0.56 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.691 2.261 . . . . 73.04 112.348 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.4 pp -105.44 138.26 41.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.266 -0.424 . . . . 72.24 110.938 179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 19.0 m-85 -118.49 152.05 36.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.2 -0.454 . . . . 74.14 110.869 179.983 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -120.06 163.14 18.1 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 73.15 111.13 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 5.6 p -133.75 119.26 32.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 74.32 111.132 179.972 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -67.14 139.19 57.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.461 . . . . 73.12 111.127 -179.962 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.0 mt -106.02 -18.37 14.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.265 -0.425 . . . . 73.35 110.941 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -139.06 163.9 31.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.168 -0.469 . . . . 74.32 110.945 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -80.44 113.45 18.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.114 -0.494 . . . . 73.11 110.908 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -98.17 111.57 23.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.217 -0.447 . . . . 74.54 110.853 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.05 121.01 26.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.491 . . . . 73.42 110.906 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.93 156.53 36.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 71.31 111.126 179.837 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -124.18 -37.69 2.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.257 -0.429 . . . . 70.34 110.891 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.7 mmt180 -128.85 178.92 6.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.179 -0.464 . . . . 72.34 110.87 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -55.84 -44.54 78.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.2 -0.455 . . . . 74.14 110.872 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -54.54 -51.91 63.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 75.51 110.883 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.55 147.94 39.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 74.05 110.858 -179.896 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.3 tp -128.82 120.81 26.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.168 -0.469 . . . . 72.12 110.951 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -66.47 137.46 56.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.461 . . . . 75.23 110.859 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.2 p -153.15 146.07 14.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 74.24 111.09 -179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.6 m -103.42 160.47 26.04 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 121.735 0.779 . . . . 71.42 110.825 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 118.36 5.64 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.685 2.257 . . . . 73.25 112.334 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.02 5.02 31.08 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.717 -0.754 . . . . 72.33 112.499 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -92.18 156.87 17.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.893 0.378 . . . . 73.42 110.899 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -104.45 133.76 48.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.152 -0.476 . . . . 75.14 110.864 -179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.4 mp -133.82 149.47 51.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.475 . . . . 73.33 110.929 179.954 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.8 t -100.86 112.59 25.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 72.14 110.869 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 57.5 mt -77.02 150.83 5.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.133 -0.485 . . . . 73.31 111.15 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 34.0 m -125.85 -36.69 2.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 74.0 110.858 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.0 179.2 9.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.456 . . . . 55.33 111.069 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -132.82 178.21 7.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 72.53 110.806 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -137.8 99.09 3.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.167 -0.47 . . . . 72.44 110.947 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.9 t70 53.07 26.54 4.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.469 . . . . 73.24 110.862 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 62.85 26.06 15.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 65.33 110.903 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -114.48 -40.27 3.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.13 -0.487 . . . . 74.25 110.894 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -122.3 155.48 35.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.12 -0.491 . . . . 73.41 110.95 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 2.4 m-85 -128.19 130.83 48.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 74.12 110.855 -179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.0 mm -91.33 94.12 4.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 71.34 111.128 179.961 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -116.23 157.07 25.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 74.12 111.116 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.3 pttp -123.25 156.84 62.8 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.564 0.697 . . . . 74.42 110.9 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 127.85 15.2 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.664 2.243 . . . . 74.41 112.401 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 60.1 mt -84.87 -44.02 17.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 72.51 111.11 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' A ASN . . . . . . . . . . . . . 25.4 m120 -91.21 -47.58 7.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.151 -0.477 . . . . 74.41 110.883 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' B ARG . . . . . . . . . . . . . 14.2 mtp180 -66.3 -170.77 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.436 . . . . 74.44 110.902 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.9 mt -129.32 122.72 30.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 74.02 110.932 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 179.95 -80.1 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.737 -0.744 . . . . 74.32 112.467 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 139.96 -165.28 25.97 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.705 -0.76 . . . . 73.54 112.496 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 134.7 28.58 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.645 2.23 . . . . 74.2 112.373 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -136.83 -120.51 1.95 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.713 -0.756 . . . . 54.41 112.443 180.0 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -159.45 125.9 4.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.832 0.348 . . . . 73.34 110.891 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 3.0 m -136.47 138.88 27.94 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.606 0.717 . . . . 65.53 111.134 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 130.01 18.57 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.664 2.243 . . . . 70.12 112.369 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 22.1 t -57.35 -21.69 15.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 71.24 111.132 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.4 p -74.34 -6.26 47.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 53.33 110.888 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -119.52 -25.27 6.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.101 -0.5 . . . . 72.52 110.893 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 1.3 t -106.16 138.69 30.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 73.3 111.105 179.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.8 ttp180 -111.2 123.64 50.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 71.51 110.855 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 24.2 mm -70.79 128.88 34.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 74.45 111.141 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 16.0 pt -145.69 174.12 3.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 72.24 111.129 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -117.84 130.19 56.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.186 -0.461 . . . . 74.44 110.872 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.8 mt -58.04 -22.73 51.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 71.32 110.895 -179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.4 mmt -89.54 -27.93 19.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 73.53 110.899 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -152.58 75.84 6.95 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.659 0.743 . . . . 74.34 110.857 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -8.52 23.82 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.676 2.251 . . . . 64.35 112.313 -179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.34 -15.33 24.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 71.53 111.128 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -76.16 -52.04 10.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 74.11 110.878 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 57.6 m-85 -96.21 23.46 6.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 75.3 110.894 -179.947 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -87.58 -18.02 30.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 53.01 111.08 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.0 p -89.96 -23.79 21.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 74.43 110.853 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 8.2 p -53.32 139.17 11.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.129 -0.487 . . . . 74.53 111.097 179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -94.32 91.38 6.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 74.42 110.893 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -51.3 -30.23 17.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.178 -0.465 . . . . 74.32 111.127 -179.866 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -58.95 -48.1 82.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 71.41 110.927 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -64.03 111.08 2.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.138 -0.483 . . . . 62.34 110.851 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.59 -24.76 34.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 74.43 110.874 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -66.79 -55.25 15.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.461 . . . . 65.24 110.907 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 3.3 mt-30 -58.77 -58.32 9.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.129 -0.487 . . . . 74.11 110.909 -179.948 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 1.8 p -51.45 -31.46 12.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 75.4 111.091 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.7 mtm -68.49 -51.58 41.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 73.23 110.879 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 32.8 mttt -56.36 -43.77 79.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.466 . . . . 75.12 110.9 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.7 mp -63.62 -56.05 19.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 74.13 111.116 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 85.2 mt -55.88 -37.16 46.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.465 . . . . 75.44 111.145 179.861 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -71.23 -51.99 21.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 72.54 110.829 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -58.5 -51.21 70.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 63.42 110.906 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -67.8 -14.77 63.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 72.5 110.883 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.5 mmtt 61.09 52.83 3.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.095 -0.502 . . . . 75.22 110.931 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 37.3 mt -81.5 131.9 56.92 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.637 0.732 . . . . 75.32 111.103 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 153.45 68.74 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.659 2.24 . . . . 74.05 112.331 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.63 165.96 13.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 73.24 111.139 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 86.1 t -51.24 -58.09 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 72.14 111.149 179.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -50.81 -51.2 53.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.176 -0.465 . . . . 74.33 110.892 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 55.5 mm-40 -57.12 -41.6 79.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.479 . . . . 74.11 110.918 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 29.3 t90 -65.37 -36.96 85.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.201 -0.454 . . . . 75.31 110.936 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.3 mmpp? -65.75 -50.08 66.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 74.31 110.875 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.62 -44.86 96.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 75.11 110.844 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 40.5 mm-40 -60.22 -47.56 85.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 74.42 110.914 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 26.4 p -65.98 -47.42 74.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.192 -0.458 . . . . 74.31 111.122 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 18.9 mmm180 -53.58 -50.89 64.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 71.45 110.856 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 23.8 mtt-85 -69.71 -32.73 71.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.466 . . . . 75.23 110.854 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 28.9 t80 -65.05 -37.62 88.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 74.44 110.889 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 38.5 mttt -84.96 -25.67 27.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 71.04 110.867 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -79.34 -177.97 5.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.245 -0.434 . . . . 74.32 110.892 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.5 m -107.72 107.96 18.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.156 -0.475 . . . . 71.14 110.843 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 1.7 m -159.93 -178.37 6.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.171 -0.468 . . . . 72.51 110.872 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 6.6 mm -104.36 161.28 4.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 74.42 111.105 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 3.2 mt-30 -71.46 -169.32 0.4 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 72.1 110.891 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 28.1 mm -139.91 94.49 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 73.53 111.118 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -129.83 118.02 2.48 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.719 -0.753 . . . . 74.5 112.47 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -119.43 129.71 54.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.862 0.363 . . . . 75.54 110.833 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -141.63 116.87 1.13 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.758 -0.734 . . . . 51.23 112.502 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -136.97 56.67 1.79 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.896 0.379 . . . . 55.34 110.844 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -138.79 -156.97 7.19 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.775 -0.726 . . . . 72.31 112.524 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -148.88 109.78 4.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.794 0.33 . . . . 75.33 110.895 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.22 137.19 57.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 62.12 110.862 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 38.8 mm-40 -76.79 164.54 25.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.148 -0.478 . . . . 72.52 110.901 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -139.72 57.88 0.6 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.739 -0.743 . . . . 74.43 112.492 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -115.83 169.0 9.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.758 0.313 . . . . 73.23 110.957 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 74.12 110.908 179.889 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.358 0 N-CA-C 112.476 -0.25 . . . . 64.3 112.476 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -78.81 -66.25 0.89 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.811 0.338 . . . . 74.33 110.87 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -68.63 -71.33 0.22 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 74.33 110.94 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 24.3 mm 51.07 74.29 0.83 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.633 0.73 . . . . 75.14 111.115 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 127.98 15.35 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.655 2.237 . . . . 65.34 112.322 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.89 12.11 9.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 73.23 110.86 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.69 162.43 0.74 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.595 0.712 . . . . 74.1 110.866 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -11.34 30.66 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.69 2.26 . . . . 71.35 112.369 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 57.79 80.93 0.26 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.59 0.709 . . . . 74.3 111.08 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 144.04 52.64 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.703 2.269 . . . . 73.02 112.326 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 38.8 mtmt -80.29 160.87 66.94 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.544 0.687 . . . . 73.41 110.906 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 165.68 30.1 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.666 2.244 . . . . 73.14 112.344 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 96.75 0.61 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.708 2.272 . . . . 60.42 112.309 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 1.5 m -115.06 -52.53 2.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 70.23 110.837 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -136.3 116.05 13.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 71.02 110.845 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 72.12 111.092 179.909 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.781 0.325 . . . . 74.44 110.91 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -51.48 160.66 0.95 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.637 0.732 . . . . 63.31 111.077 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 124.61 11.27 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.686 2.257 . . . . 75.23 112.352 179.983 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -108.97 119.47 39.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 75.51 110.919 179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 81.0 m-85 -137.92 139.89 40.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 75.13 110.879 179.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -130.34 157.99 41.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.135 -0.484 . . . . 62.41 111.133 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.5 p -124.13 128.5 74.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 71.0 111.149 179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -72.48 127.43 32.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 73.24 111.133 -179.934 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.3 mt -101.21 -18.66 16.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.204 -0.453 . . . . 63.33 110.913 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -133.78 161.56 34.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 74.52 110.898 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -82.02 105.49 13.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 71.44 110.876 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -87.28 125.46 34.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 72.51 110.879 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.43 104.39 14.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 74.43 110.874 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.53 160.37 1.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 64.24 111.094 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -118.47 -32.22 4.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 74.5 110.879 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -124.09 -175.79 3.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 71.25 110.821 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -67.07 -38.93 86.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.459 . . . . 64.12 110.852 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -59.65 -53.1 61.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.231 -0.44 . . . . 75.24 110.844 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -54.24 164.65 0.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.218 -0.446 . . . . 74.33 110.862 -179.92 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.5 tp -139.46 142.8 37.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.489 . . . . 73.44 110.868 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -86.6 143.09 27.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.466 . . . . 73.34 110.848 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.7 p -153.11 144.03 14.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.226 -0.443 . . . . 74.25 111.109 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.4 m -102.32 160.33 26.67 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.637 0.732 . . . . 72.53 110.873 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 126.38 13.26 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.652 2.235 . . . . 74.51 112.332 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.0 -0.21 31.64 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.737 -0.744 . . . . 74.53 112.508 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -92.11 170.37 9.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.86 0.362 . . . . 74.5 110.86 -179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -116.26 130.06 56.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 74.3 110.852 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.1 mp -125.09 144.79 50.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.17 -0.468 . . . . 74.33 110.927 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -97.31 112.66 24.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 72.31 110.842 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 58.8 mt -78.86 141.52 15.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 74.23 111.108 179.971 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 55.3 m -119.33 -48.81 2.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 73.24 110.861 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -146.09 172.68 13.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 74.54 111.084 -179.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -128.06 178.25 6.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.242 -0.435 . . . . 72.23 110.829 -179.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -138.77 99.88 3.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 75.15 110.933 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.1 t70 54.26 26.35 6.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.135 -0.484 . . . . 60.21 110.839 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 38.4 m-85 63.08 25.37 14.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.204 -0.453 . . . . 73.22 110.933 -179.851 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -114.11 -50.01 2.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 74.44 110.858 -179.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 67.9 m95 -111.42 143.97 41.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.167 -0.47 . . . . 75.33 110.9 -179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -119.69 133.5 55.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.442 . . . . 74.41 110.918 -179.99 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.8 mm -88.79 95.23 5.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 72.31 111.145 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -110.6 142.7 42.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.205 -0.452 . . . . 75.33 111.105 179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.52 153.63 46.65 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.558 0.694 . . . . 72.13 110.889 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 105.89 1.57 Allowed 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.683 2.255 . . . . 64.05 112.369 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.7 mt -68.52 -36.7 75.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.242 -0.435 . . . . 75.13 111.107 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' A ASN . . . . . . . . . . . . . 40.9 m-80 -98.05 -59.93 1.66 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.203 -0.453 . . . . 73.32 110.845 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' B ARG . . . . . . . . . . . . . 5.6 mmp_? -53.57 165.76 0.37 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 73.42 110.87 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 12.4 mt -128.9 120.97 27.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.457 . . . . 63.52 110.91 179.991 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 179.05 -41.53 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.729 -0.748 . . . . 74.51 112.48 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 137.61 165.78 10.5 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.687 -0.768 . . . . 71.41 112.511 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.76 144.99 55.77 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.665 2.244 . . . . 74.31 112.325 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -127.7 -137.1 4.39 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.754 -0.736 . . . . 55.14 112.468 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.2 tt -149.55 125.84 10.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.861 0.362 . . . . 73.24 110.908 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 12.4 p -136.58 132.7 18.77 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.622 0.725 . . . . 64.52 111.096 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 151.53 68.97 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.707 2.272 . . . . 64.43 112.287 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 14.2 t -62.9 -21.9 29.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.232 -0.44 . . . . 73.13 111.155 179.892 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.1 m -78.4 -2.4 38.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 64.21 110.877 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -125.07 17.58 8.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 74.22 110.907 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 5.2 m -153.56 153.1 9.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 73.14 111.127 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 18.5 ttm180 -123.75 119.84 30.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.151 -0.477 . . . . 72.02 110.915 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 16.1 mm -67.19 113.81 3.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 75.55 111.168 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.2 pt -135.33 139.07 47.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 70.03 111.126 179.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -75.27 122.07 23.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 74.25 110.878 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -51.98 -31.7 30.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.213 -0.449 . . . . 74.4 110.876 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -85.56 -28.52 24.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 74.04 110.869 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -143.96 77.53 14.61 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.638 0.732 . . . . 64.14 110.896 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 -8.17 22.92 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.675 2.25 . . . . 75.12 112.367 -179.973 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.91 -5.69 44.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 70.13 111.125 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -84.04 -51.75 6.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 73.34 110.904 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 12.2 m-85 -99.87 23.62 9.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 74.21 110.931 -179.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -83.37 -15.93 47.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.122 -0.49 . . . . 70.32 111.112 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 8.9 m -98.14 -18.74 18.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.44 110.894 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 9.3 p -51.14 150.22 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.092 -0.504 . . . . 74.1 111.129 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -104.76 88.5 2.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 74.12 110.84 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.89 -43.22 63.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.219 -0.446 . . . . 71.45 111.089 -179.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -53.67 -43.89 69.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.282 -0.417 . . . . 74.11 110.92 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -63.92 110.15 2.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 71.11 110.864 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.23 -26.33 28.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 75.04 110.857 -179.862 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -67.11 -56.07 11.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 71.01 110.893 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -59.2 -56.65 19.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.479 . . . . 75.51 110.902 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 2.8 p -52.48 -32.38 16.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.199 -0.455 . . . . 61.44 111.168 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 14.2 mtm -67.73 -55.0 14.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 75.52 110.879 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.5 mttt -54.34 -38.51 66.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 75.51 110.928 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 88.6 mt -66.05 -54.64 24.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.225 -0.443 . . . . 75.0 111.149 179.875 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 95.1 mt -60.37 -33.88 55.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 73.33 111.163 179.81 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -71.07 -51.84 22.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.176 -0.466 . . . . 55.01 110.83 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -60.49 -43.09 97.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 72.41 110.915 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -76.13 -17.78 59.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 74.42 110.847 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 33.5 mmtm 61.36 52.53 3.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.178 -0.464 . . . . 71.41 110.891 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 21.2 mt -78.4 131.09 69.59 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.639 0.733 . . . . 74.33 111.116 179.877 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 158.87 55.5 Favored 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.753 2.302 . . . . 74.42 112.297 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.41 163.25 16.86 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.183 -0.462 . . . . 73.04 111.147 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.2 t -51.01 -58.02 2.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 74.42 111.169 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -50.85 -46.8 60.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 70.15 110.873 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -59.4 -42.2 91.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 75.13 110.915 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 12.2 t90 -64.96 -41.55 95.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 75.25 110.912 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.3 mmtp -62.6 -44.67 95.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.248 -0.433 . . . . 72.21 110.903 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -64.3 -46.67 82.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.258 -0.428 . . . . 74.22 110.873 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -57.73 -53.72 55.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 73.54 110.927 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 4.6 p -61.04 -46.68 89.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.204 -0.453 . . . . 74.13 111.081 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 19.7 mmm-85 -51.97 -53.88 36.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.25 -0.432 . . . . 75.43 110.867 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 34.0 mtp180 -65.98 -32.85 74.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 74.14 110.888 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -64.98 -41.05 95.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 74.45 110.916 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 35.5 mttp -74.61 -25.17 59.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.133 -0.485 . . . . 74.44 110.914 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -93.38 -175.14 3.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 74.14 110.898 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 44.4 m -70.19 120.93 16.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 73.25 110.812 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 13.8 m -72.31 175.03 6.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.108 -0.496 . . . . 72.42 110.89 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.3 mt -70.41 139.03 20.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.135 -0.484 . . . . 73.3 111.159 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 179.0 167.71 0.94 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 74.24 110.887 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.24 173.96 6.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 74.42 111.141 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 159.49 116.25 0.43 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.778 -0.725 . . . . 63.02 112.499 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -68.56 132.29 46.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.859 0.362 . . . . 72.2 110.89 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 176.96 -95.19 0.1 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.77 -0.729 . . . . 65.11 112.487 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -91.38 102.92 15.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.843 0.354 . . . . 74.13 110.825 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 86.16 150.5 15.73 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.75 -0.738 . . . . 74.35 112.527 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.4 mp0 -86.5 104.03 15.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.812 0.339 . . . . 75.52 110.911 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.4 m -88.01 -177.56 5.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.197 -0.456 . . . . 74.34 110.849 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -109.57 138.26 46.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.118 -0.492 . . . . 75.13 110.917 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -148.16 117.52 0.9 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.77 -0.728 . . . . 61.34 112.484 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -151.75 170.34 19.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.792 0.33 . . . . 75.32 110.915 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 74.31 110.898 179.934 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.306 0 N-CA-C 112.487 -0.245 . . . . 72.53 112.487 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 25.8 mtmm -122.48 -47.83 2.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.809 0.337 . . . . 72.34 110.892 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -80.21 -72.0 0.43 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 74.05 110.865 -179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 22.2 mm 51.94 77.6 0.45 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.596 0.713 . . . . 64.35 111.106 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 92.64 0.51 Allowed 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.712 2.275 . . . . 70.51 112.324 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.09 28.53 3.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.269 -0.423 . . . . 64.52 110.884 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' -3' ' ' ARG . . . . . 0.46 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 0.5 OUTLIER -89.64 159.09 44.43 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.58 0.705 . . . . 75.51 110.883 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' -2' ' ' PRO . . . . . 0.46 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 54.1 Cg_endo -69.78 112.41 3.08 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.669 2.246 . . . . 74.34 112.356 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -51.22 108.99 1.18 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.641 0.734 . . . . 73.42 111.087 179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 147.14 61.98 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.647 2.231 . . . . 71.31 112.373 179.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 60.5 mttt -97.6 160.77 27.88 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.592 0.711 . . . . 74.01 110.868 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 167.85 23.28 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.654 2.236 . . . . 74.21 112.372 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 112.57 3.11 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.666 2.244 . . . . 75.03 112.372 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 85.7 p -145.31 173.19 12.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 75.53 110.897 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 5.9 p -119.21 103.88 9.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.485 . . . . 62.43 110.856 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.135 -0.484 . . . . 62.41 111.084 179.902 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.751 0.31 . . . . 75.35 110.925 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -120.4 160.34 44.19 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.585 0.707 . . . . 71.11 111.113 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 122.4 9.09 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.702 2.268 . . . . 73.45 112.314 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -120.14 147.19 45.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.248 -0.433 . . . . 75.41 110.962 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -124.48 143.14 50.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 73.43 110.849 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -120.88 151.98 39.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 73.41 111.088 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.2 p -120.17 122.19 67.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.196 -0.457 . . . . 73.22 111.112 179.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -60.24 144.53 50.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 52.05 111.118 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 23.3 mt -117.48 -12.17 10.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 64.42 110.873 179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -134.67 164.75 26.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.238 -0.437 . . . . 65.02 110.94 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -89.97 105.27 17.7 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.133 -0.485 . . . . 75.31 110.859 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -87.3 123.47 32.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.149 -0.478 . . . . 71.4 110.861 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.84 96.88 7.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.176 -0.466 . . . . 75.4 110.905 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.13 157.69 1.75 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.245 -0.434 . . . . 71.43 111.118 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -116.26 -30.6 5.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.21 -0.45 . . . . 72.24 110.876 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.5 mmm180 -136.2 -177.11 4.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 74.32 110.869 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -60.39 -41.2 93.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.156 -0.475 . . . . 64.44 110.873 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -56.93 -39.85 75.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.145 -0.479 . . . . 74.33 110.864 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -79.87 143.03 34.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.206 -0.452 . . . . 70.04 110.913 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.8 tp -119.89 127.8 53.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.145 -0.479 . . . . 64.43 110.869 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -72.94 139.77 46.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.209 -0.451 . . . . 65.44 110.852 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 11.2 p -147.14 151.75 13.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.465 . . . . 72.21 111.134 -180.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.5 m -110.23 159.91 30.27 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.657 0.741 . . . . 73.14 110.853 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 120.15 6.98 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.644 2.229 . . . . 71.22 112.357 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.08 3.64 31.46 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.76 -0.733 . . . . 53.13 112.496 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -91.97 149.47 21.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.881 0.372 . . . . 65.3 110.88 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -93.79 139.86 30.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 75.41 110.926 -179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.4 mp -141.23 145.4 35.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 74.23 110.903 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.1 113.9 26.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.444 . . . . 64.35 110.877 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 43.5 mt -77.22 149.76 6.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.153 -0.476 . . . . 73.32 111.138 179.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 21.3 m -123.55 -35.91 2.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 71.42 110.863 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -166.52 173.62 9.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.182 -0.463 . . . . 63.22 111.085 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -124.11 176.28 6.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 71.23 110.848 -179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -137.76 99.56 3.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 75.42 110.887 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.3 t70 55.07 24.92 6.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.105 -0.498 . . . . 74.5 110.895 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 64.08 15.69 9.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 63.54 110.95 -179.768 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 28.1 mm-40 -103.34 -50.65 3.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.125 -0.489 . . . . 72.55 110.858 -179.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 83.0 m95 -111.5 162.86 14.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.146 -0.479 . . . . 75.24 110.964 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -135.93 146.24 47.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.263 -0.426 . . . . 75.43 110.896 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 11.6 mm -104.12 95.23 3.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.142 -0.481 . . . . 73.04 111.122 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -116.42 145.07 43.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.15 -0.477 . . . . 60.41 111.075 179.826 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.0 ptpp? -116.14 157.46 45.12 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.59 0.709 . . . . 74.34 110.872 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 131.5 21.46 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.713 2.276 . . . . 55.12 112.339 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 40.5 mt -91.04 -44.17 14.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.213 -0.449 . . . . 74.23 111.116 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' A ASN . . . . . . . . . . . . . 32.8 t30 -53.35 -73.84 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.126 -0.488 . . . . 74.34 110.914 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' B ARG . . . . . . . . . . . . . 9.3 ptm180 -93.24 -179.83 5.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.13 -0.486 . . . . 62.35 110.849 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.0 mp -84.9 -74.75 0.38 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.14 -0.482 . . . . 72.13 110.876 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 52.78 -108.18 0.67 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.722 -0.751 . . . . 72.32 112.469 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -179.97 165.22 33.53 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.702 -0.761 . . . . 64.55 112.458 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 131.73 21.86 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.685 2.257 . . . . 62.21 112.323 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -119.57 -153.52 9.3 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.766 -0.73 . . . . 52.43 112.52 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -130.32 129.33 43.06 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.856 0.36 . . . . 75.23 110.91 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.5 p -141.15 132.04 13.42 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.668 0.746 . . . . 71.15 111.098 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.74 165.51 30.69 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.662 2.241 . . . . 73.41 112.363 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 15.3 t -74.1 -21.24 17.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.24 -0.437 . . . . 61.42 111.154 179.876 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 56.4 m -81.3 1.8 30.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.17 -0.468 . . . . 75.44 110.832 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 13.9 m-85 -129.26 22.75 5.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 75.54 110.911 -179.892 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 27.5 m -151.3 146.41 16.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 75.11 111.096 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 33.3 ttp85 -115.64 111.66 20.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 65.54 110.912 -179.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.4 mm -66.05 118.55 9.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.207 -0.451 . . . . 74.33 111.074 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 15.3 pt -136.1 165.89 28.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 64.11 111.147 179.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -109.21 127.31 54.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 70.32 110.867 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.9 mt -55.48 -29.59 59.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 73.51 110.889 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.58 -20.19 28.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 74.03 110.935 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -161.45 82.1 1.93 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.648 0.737 . . . . 75.44 110.819 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -8.52 23.81 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.717 2.278 . . . . 72.34 112.351 -179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.79 0.25 56.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 75.1 111.109 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -84.31 -47.15 11.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 74.42 110.889 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 19.0 m-85 -110.98 23.71 13.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 74.42 110.914 -179.927 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -78.07 -20.82 51.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 72.21 111.077 179.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 80.9 p -104.59 -8.42 18.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.428 . . . . 71.23 110.846 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 9.8 p -51.37 157.84 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 71.44 111.123 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -104.09 82.46 1.97 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.138 -0.483 . . . . 72.3 110.871 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -54.29 -44.64 72.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.448 . . . . 74.14 111.093 -179.877 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -55.28 -40.92 71.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.239 -0.437 . . . . 63.11 110.948 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -63.96 108.42 1.49 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.103 -0.499 . . . . 73.23 110.852 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -51.97 -29.3 19.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.455 . . . . 61.31 110.876 -179.908 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -66.98 -56.42 10.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 73.4 110.869 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -59.23 -54.9 41.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.461 . . . . 72.22 110.936 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 4.8 p -54.27 -32.68 24.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 74.24 111.121 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.4 mtm -67.37 -56.04 11.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.474 . . . . 73.32 110.817 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -54.62 -37.51 65.71 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.247 -0.433 . . . . 74.44 110.911 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 27.9 mt -66.22 -55.1 20.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 74.43 111.14 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 96.4 mt -60.51 -36.73 71.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.153 -0.476 . . . . 70.43 111.149 179.848 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -70.93 -46.73 61.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.156 -0.475 . . . . 75.33 110.857 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -64.42 -47.1 80.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 75.32 110.853 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -72.34 -12.84 61.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 75.41 110.898 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.56 53.06 6.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.137 -0.483 . . . . 75.31 110.881 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 59.0 mt -83.73 132.94 47.44 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.64 0.733 . . . . 75.41 111.105 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 163.83 36.81 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.705 2.27 . . . . 75.25 112.324 179.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.28 169.2 9.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.173 -0.467 . . . . 74.13 111.135 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 91.7 t -51.43 -56.53 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 71.51 111.131 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -52.43 -52.13 55.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 75.45 110.857 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 57.7 mm-40 -56.86 -42.68 80.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 73.43 110.886 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 33.4 t90 -66.1 -36.93 84.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 75.21 110.898 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -68.43 -35.03 77.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 74.42 110.892 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -72.16 -49.46 35.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 63.14 110.834 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -61.56 -39.94 92.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 71.54 110.905 -179.914 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 38.1 p -70.57 -44.53 67.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 75.13 111.153 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -59.17 -44.71 92.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 75.4 110.902 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -74.26 -34.11 63.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 74.41 110.898 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -69.18 -29.6 67.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 74.13 110.966 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -90.88 -17.45 26.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.101 -0.499 . . . . 71.32 110.877 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.01 179.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.431 . . . . 61.43 110.933 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.4 m -81.58 -176.52 6.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 72.21 110.857 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 4.1 m 59.74 36.93 22.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 54.22 110.914 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 20.2 mm -113.36 148.5 16.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.111 -0.495 . . . . 74.33 111.163 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -169.0 129.62 1.13 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 74.13 110.877 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.2 mp -132.24 151.64 35.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 73.21 111.13 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -80.46 56.68 4.7 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.681 -0.771 . . . . 75.33 112.51 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -120.05 150.01 41.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.856 0.36 . . . . 55.54 110.934 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -93.5 58.58 2.26 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.745 -0.741 . . . . 72.4 112.523 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -175.08 140.45 0.52 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.866 0.365 . . . . 70.41 110.868 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 167.48 142.96 3.62 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.755 -0.736 . . . . 74.02 112.48 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -168.63 146.26 3.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.784 0.325 . . . . 75.21 110.942 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 2.8 p -108.86 174.84 5.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 75.42 110.894 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 32.5 mm-40 -146.85 179.62 7.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 73.14 110.893 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -175.12 121.96 0.85 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.722 -0.751 . . . . 73.55 112.479 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 2.3 mp -127.06 -67.86 0.83 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.773 0.32 . . . . 71.1 110.942 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.474 . . . . 72.13 110.878 179.95 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 N-CA-C 112.525 -0.23 . . . . 53.23 112.525 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 4.1 pttp -133.24 -43.29 0.86 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.805 0.336 . . . . 73.54 110.907 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 -55.43 -74.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 75.11 110.868 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.0 mm 51.83 81.0 0.27 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.607 0.718 . . . . 74.51 111.092 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 81.43 0.82 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.671 2.247 . . . . 73.33 112.309 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 5.4 t -97.21 37.27 1.35 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 72.1 110.861 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' -3' ' ' ARG . . . . . 0.411 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 5.6 mmm180 -98.16 160.56 27.98 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.596 0.713 . . . . 74.14 110.879 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' -2' ' ' PRO . . . . . 0.411 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.6 Cg_endo -69.79 99.53 0.76 Allowed 'Trans proline' 0 C--N 1.34 0.13 0 C-N-CA 122.657 2.238 . . . . 74.44 112.31 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -51.13 108.96 1.17 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.542 0.687 . . . . 72.14 111.094 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 154.25 67.98 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.704 2.269 . . . . 74.51 112.334 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 12.7 mtpp -99.56 160.66 26.83 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.539 0.685 . . . . 74.44 110.87 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 167.82 23.32 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.693 2.262 . . . . 74.55 112.335 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 -42.76 3.15 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.683 2.255 . . . . 65.31 112.359 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 3.4 m -79.73 59.34 3.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 65.24 110.866 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 85.5 p -91.3 -56.96 2.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 73.54 110.877 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 62.14 111.1 179.897 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.812 0.339 . . . . 72.21 110.852 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -74.17 160.51 81.38 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.534 0.683 . . . . 75.24 111.092 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 172.81 11.99 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.69 2.26 . . . . 75.02 112.327 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -155.02 120.43 5.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 55.25 110.923 179.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 97.1 m-85 -128.55 139.55 52.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.466 . . . . 73.4 110.866 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.93 159.55 40.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.49 . . . . 71.4 111.111 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.6 p -124.75 127.05 72.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 75.52 111.11 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -67.04 126.95 30.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.209 -0.451 . . . . 62.21 111.106 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 66.1 mt -101.73 -17.68 16.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 60.31 110.906 179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -132.87 160.82 35.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 72.3 110.889 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -86.42 105.08 16.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.084 -0.507 . . . . 72.4 110.852 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -84.81 126.17 33.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 74.22 110.894 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.4 mttm -101.91 100.17 10.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.119 -0.491 . . . . 75.53 110.905 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.74 149.68 5.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 70.3 111.091 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -123.05 -36.34 2.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 73.02 110.884 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.9 mmt180 -114.56 -178.19 3.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 75.14 110.861 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -68.36 -35.68 78.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 73.31 110.865 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -67.96 -41.17 82.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.242 -0.436 . . . . 61.25 110.858 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.15 166.77 3.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 72.34 110.904 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.2 tp -142.37 149.96 40.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 75.12 110.948 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -94.67 131.46 40.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 71.53 110.867 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.8 p -148.59 149.49 15.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 72.44 111.101 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.9 m -110.67 160.43 28.7 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.646 0.736 . . . . 74.44 110.859 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 128.2 15.67 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.71 2.273 . . . . 72.22 112.334 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.09 -6.02 32.28 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.709 -0.758 . . . . 54.12 112.509 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -92.2 155.18 18.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.852 0.358 . . . . 73.42 110.871 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.1 m120 -96.14 139.25 32.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.03 110.917 -179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -131.57 142.01 49.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.18 -0.464 . . . . 72.13 110.886 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.82 116.78 33.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.209 -0.45 . . . . 61.53 110.842 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 26.4 mt -84.08 146.01 7.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.106 -0.497 . . . . 72.21 111.115 179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 22.9 m -118.53 -27.76 5.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 74.42 110.828 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -169.67 178.48 4.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.45 . . . . 65.53 111.128 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -129.47 176.59 7.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.254 -0.43 . . . . 72.32 110.862 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -137.89 99.4 3.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 74.1 110.857 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 46.6 t0 54.31 25.69 6.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 72.45 110.831 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 25.6 m-85 63.26 23.1 13.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.194 -0.457 . . . . 71.01 110.958 -179.828 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.9 mm-40 -111.79 -53.3 2.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.505 . . . . 73.33 110.899 179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 79.9 m95 -109.13 144.26 37.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.152 -0.477 . . . . 74.55 110.929 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -117.59 130.09 56.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.435 . . . . 75.41 110.873 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.1 mm -87.9 95.11 4.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.119 -0.491 . . . . 72.21 111.153 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -110.09 157.75 19.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 65.21 111.066 179.854 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -132.33 157.94 76.93 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.558 0.694 . . . . 74.12 110.872 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 115.15 3.95 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.679 2.253 . . . . 75.23 112.324 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.8 mt -79.36 -44.59 23.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.469 . . . . 75.41 111.145 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' A ASN . . . . . . . . . . . . . 5.1 m-20 -52.97 -64.02 0.95 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.214 -0.448 . . . . 73.43 110.908 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' B ARG . . . . . . . . . . . . . 0.3 OUTLIER -103.97 169.87 8.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.455 . . . . 74.3 110.831 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 56.2 mt -74.29 -73.03 0.25 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.161 -0.472 . . . . 74.31 110.911 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 52.64 -111.39 1.6 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.709 -0.758 . . . . 40.54 112.452 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -174.33 165.88 37.59 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.757 -0.735 . . . . 65.01 112.507 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 139.5 40.43 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.703 2.268 . . . . 71.25 112.353 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -128.17 -144.97 5.96 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.746 -0.74 . . . . 60.23 112.514 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -147.98 129.87 15.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.869 0.366 . . . . 72.34 110.867 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.0 p -142.36 132.83 12.59 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.634 0.731 . . . . 75.03 111.101 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 152.27 69.18 Favored 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.656 2.238 . . . . 74.15 112.355 179.934 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 13.7 t -62.52 -22.31 29.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.225 -0.443 . . . . 73.23 111.146 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.9 t -78.04 -3.18 40.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.144 -0.48 . . . . 72.35 110.889 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -123.57 18.05 9.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 64.35 110.938 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.8 m -153.95 149.41 12.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.093 -0.503 . . . . 72.33 111.142 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.4 ttm180 -116.41 118.12 31.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.47 . . . . 75.04 110.897 -179.973 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 24.3 mm -70.12 116.47 11.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 75.4 111.132 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 11.3 pt -134.71 172.02 16.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.479 . . . . 73.04 111.122 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -115.06 147.17 40.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.171 -0.468 . . . . 55.24 110.85 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.2 mt -72.59 -35.54 67.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.455 . . . . 75.11 110.932 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 21.1 mmt -81.93 -25.21 35.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.142 -0.481 . . . . 73.13 110.865 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -151.94 74.13 7.77 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.605 0.717 . . . . 74.24 110.88 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 -8.62 24.07 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.662 2.241 . . . . 75.24 112.381 -179.997 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.73 -14.77 25.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.195 -0.457 . . . . 74.4 111.071 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -75.01 -51.96 12.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.273 -0.421 . . . . 75.34 110.913 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -95.4 23.02 6.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 74.23 110.908 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -87.57 -21.17 25.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.118 -0.492 . . . . 72.14 111.113 179.84 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.6 t -95.37 -21.12 18.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.439 . . . . 72.54 110.865 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 10.7 p -51.57 149.22 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.116 -0.493 . . . . 72.34 111.133 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -99.32 105.77 17.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 73.13 110.835 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -68.37 -39.72 81.68 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.146 -0.479 . . . . 75.45 111.115 -179.874 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 35.2 t80 -54.05 -44.31 70.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 74.35 110.922 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.99 108.94 1.63 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 72.34 110.854 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.6 -25.18 37.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 74.12 110.839 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -66.48 -54.75 20.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.185 -0.462 . . . . 75.45 110.948 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 3.8 mm100 -59.27 -57.09 14.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.079 -0.509 . . . . 64.35 110.943 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -52.66 -31.56 16.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 71.24 111.132 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.9 mtm -68.25 -54.31 18.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.135 -0.484 . . . . 71.44 110.849 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.0 mttm -55.69 -39.95 71.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.43 . . . . 75.21 110.857 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 67.4 mt -64.93 -54.36 30.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 65.34 111.108 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 96.9 mt -59.98 -29.65 43.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 75.55 111.128 179.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -70.76 -52.7 19.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 75.43 110.855 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.01 -31.37 71.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 72.42 110.898 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -81.32 -6.48 58.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.156 -0.475 . . . . 71.41 110.852 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 50.7 42.81 27.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.163 -0.471 . . . . 72.3 110.923 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 3.8 mt -81.01 119.06 74.95 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.665 0.745 . . . . 75.32 111.091 179.91 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 155.8 64.97 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.699 2.266 . . . . 75.22 112.336 179.869 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.19 176.97 9.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.444 . . . . 63.0 111.129 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.8 t -57.67 -53.02 50.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.221 -0.445 . . . . 73.21 111.099 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -51.63 -49.19 62.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 64.53 110.887 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 67.6 mm-40 -58.82 -41.13 86.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 71.35 110.892 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 30.0 t90 -64.68 -42.61 95.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.195 -0.457 . . . . 74.31 110.911 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -61.98 -50.42 72.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.451 . . . . 75.24 110.915 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -61.43 -41.35 97.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 75.21 110.86 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -59.88 -51.07 71.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 74.41 110.855 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.1 p -64.32 -45.94 85.69 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.24 -0.436 . . . . 74.33 111.13 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -53.3 -53.02 57.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 75.23 110.936 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 51.9 mtt180 -67.42 -34.69 77.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 73.43 110.843 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -62.97 -38.44 91.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 75.51 110.913 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 5.4 mtpp -74.9 -25.71 59.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.131 -0.486 . . . . 71.43 110.879 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -89.18 175.1 7.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 72.23 110.911 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.8 t 53.92 40.07 31.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 75.13 110.851 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 15.5 m -79.94 -170.74 2.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 74.52 110.844 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 43.0 mm -51.48 -70.64 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 74.52 111.143 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -53.39 163.22 0.63 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.127 -0.488 . . . . 74.15 110.904 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 3.0 mt -118.47 132.08 69.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 73.41 111.1 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -114.26 -91.64 1.85 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.698 -0.763 . . . . 75.14 112.474 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -119.16 134.23 55.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.829 0.347 . . . . 74.54 110.912 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 99.85 -141.12 15.31 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.746 -0.74 . . . . 70.14 112.48 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 57.1 m80 -60.25 -176.87 0.05 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.884 0.373 . . . . 74.25 110.87 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -139.93 -86.12 0.12 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.777 -0.725 . . . . 75.14 112.526 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 21.1 mp0 -53.98 123.31 12.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.859 0.361 . . . . 74.42 110.939 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 66.7 m -144.84 153.72 41.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.233 -0.44 . . . . 73.01 110.832 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -54.33 126.8 24.63 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.108 -0.496 . . . . 70.34 110.91 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -86.28 103.48 2.8 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.748 -0.739 . . . . 42.34 112.497 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -115.77 -21.8 9.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.782 0.325 . . . . 62.54 110.915 -179.953 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 74.43 110.883 179.937 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.312 0 N-CA-C 112.441 -0.263 . . . . 75.43 112.441 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 3.5 pttm -111.97 -25.71 9.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.845 0.355 . . . . 74.14 110.917 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -72.04 -74.76 0.15 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 64.11 110.832 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 23.8 mm 51.31 77.97 0.43 Allowed Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.632 0.729 . . . . 72.41 111.131 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 90.96 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.66 2.24 . . . . 62.03 112.32 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 16.3 t -102.79 34.56 2.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 72.02 110.853 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 3.3 mtp85 -95.31 160.3 30.97 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.554 0.693 . . . . 74.45 110.93 -179.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 102.51 1.04 Allowed 'Trans proline' 0 N--CA 1.466 -0.145 0 C-N-CA 122.718 2.279 . . . . 74.24 112.381 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -51.05 108.9 1.15 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.615 0.721 . . . . 73.3 111.139 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.71 150.94 69.18 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.745 2.297 . . . . 71.43 112.301 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -97.95 160.87 27.38 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.53 0.681 . . . . 73.12 110.92 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.76 167.88 23.16 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.649 2.232 . . . . 74.31 112.368 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 150.7 68.6 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.61 2.207 . . . . 73.52 112.373 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 46.1 m -109.07 172.71 6.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 72.42 110.854 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 19.4 t -116.28 -60.36 1.87 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.111 -0.495 . . . . 73.42 110.834 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.163 -0.472 . . . . 74.52 111.15 179.846 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 21.4 ptm . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.801 0.334 . . . . 74.44 110.844 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -146.09 160.43 43.05 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.548 0.689 . . . . 62.21 111.136 179.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 78.75 1.0 Allowed 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.71 2.273 . . . . 72.53 112.329 -179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -88.56 156.13 19.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.217 -0.447 . . . . 71.21 110.889 179.98 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -134.65 140.01 45.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 74.32 110.902 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -111.24 169.76 8.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.485 . . . . 71.41 111.063 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.6 p -136.94 124.93 33.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.459 . . . . 73.31 111.1 -179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -73.07 147.48 44.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 74.44 111.161 179.988 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 18.0 mt -118.14 -11.82 10.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.234 -0.439 . . . . 73.14 110.909 179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -140.18 166.91 23.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 74.34 110.967 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -89.88 110.04 21.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 72.34 110.896 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 23.0 t80 -91.43 116.15 28.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 75.54 110.887 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.56 108.44 19.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.497 . . . . 72.14 110.878 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.27 158.98 15.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 75.25 111.09 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -124.68 -37.14 2.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.256 -0.429 . . . . 63.11 110.872 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.8 mmt180 -122.29 167.16 13.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.475 . . . . 75.5 110.875 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -53.63 -40.76 66.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 65.32 110.887 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -65.04 -25.35 67.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.254 -0.43 . . . . 75.32 110.858 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -90.29 129.07 36.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 72.41 110.909 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.8 tp -108.29 145.07 34.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 65.11 110.879 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -89.09 150.26 22.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 75.32 110.876 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 8.8 p -147.43 156.16 10.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 74.23 111.136 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 14.1 p -111.02 154.51 43.41 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.638 0.732 . . . . 74.11 110.879 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 128.17 15.66 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.691 2.261 . . . . 74.25 112.402 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.8 -2.93 60.48 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.794 -0.717 . . . . 63.03 112.521 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -85.6 158.41 20.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.846 0.355 . . . . 74.13 110.901 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.4 m120 -101.39 131.95 47.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 74.34 110.903 -179.947 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -123.66 159.97 28.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.161 -0.472 . . . . 74.14 110.918 -179.985 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.81 112.88 25.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.446 . . . . 72.31 110.89 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 38.2 mm -70.88 143.27 14.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.126 -0.488 . . . . 74.21 111.169 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.2 m -122.92 -35.83 2.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 72.3 110.861 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -170.78 173.4 5.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 74.14 111.118 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -128.12 176.18 7.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 74.14 110.859 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -137.78 99.86 4.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 73.21 110.902 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.5 t0 54.4 25.75 6.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.119 -0.491 . . . . 73.44 110.798 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 63.27 26.34 15.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.224 -0.443 . . . . 74.43 110.911 -179.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 16.9 mm-40 -115.64 -46.56 2.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.103 -0.499 . . . . 74.14 110.882 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -114.73 146.95 40.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.177 -0.465 . . . . 75.5 110.894 -179.966 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -123.82 143.66 50.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 71.41 110.902 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.6 mm -101.22 98.49 6.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 74.32 111.131 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -110.86 138.36 47.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.155 -0.475 . . . . 62.42 111.131 179.808 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -112.59 157.56 39.94 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.571 0.7 . . . . 72.3 110.906 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 131.24 20.87 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.659 2.239 . . . . 75.31 112.388 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 35.9 mt -90.09 -31.95 5.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.227 -0.442 . . . . 75.54 111.134 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' A ASN . . . . . . . . . . . . . 11.4 t-20 -90.92 -53.7 4.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 74.03 110.865 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' B ARG . . . . . . . . . . . . . 22.7 mmt180 -61.05 -169.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 74.54 110.901 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.3 mt -92.76 -169.34 2.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 72.24 110.898 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.78 108.48 1.57 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.746 -0.74 . . . . 55.31 112.521 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -158.11 66.52 0.29 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.768 -0.73 . . . . 72.24 112.496 -179.871 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.85 117.41 5.07 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.699 2.266 . . . . 73.14 112.312 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -117.68 -166.87 14.07 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.776 -0.726 . . . . 54.4 112.541 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -120.9 124.83 45.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.897 0.38 . . . . 65.03 110.857 -179.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.2 p -134.94 133.13 20.75 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.635 0.731 . . . . 71.21 111.132 179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 153.87 68.44 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.721 2.281 . . . . 75.54 112.332 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 11.8 t -65.55 -21.65 29.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.204 -0.453 . . . . 73.44 111.151 179.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 7.1 m -78.57 -1.86 36.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 62.14 110.8 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -121.38 2.18 10.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.185 -0.461 . . . . 71.13 110.921 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 17.0 m -139.45 160.16 28.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.493 . . . . 70.01 111.111 179.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 17.9 ttm180 -127.26 123.64 36.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.167 -0.47 . . . . 74.23 110.862 -179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 24.8 mm -74.39 110.29 8.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.471 . . . . 63.22 111.129 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 6.7 pt -124.27 -177.87 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.155 -0.475 . . . . 75.32 111.138 179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -128.64 145.9 51.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 73.14 110.908 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 1.5 mp -73.29 -38.3 65.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 74.02 110.926 -179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.83 -24.12 52.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 72.54 110.912 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -155.31 75.96 5.16 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.626 0.727 . . . . 73.44 110.856 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 -8.32 23.31 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.663 2.242 . . . . 64.33 112.367 -179.998 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.81 -15.36 23.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.447 . . . . 72.05 111.085 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -77.73 -51.66 10.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.252 -0.431 . . . . 72.03 110.914 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 57.1 m-85 -95.35 23.15 6.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.255 -0.429 . . . . 74.45 110.915 -179.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -88.03 -23.81 23.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.095 -0.502 . . . . 70.21 111.1 179.853 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 13.0 p -91.68 -9.72 42.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 71.54 110.835 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 55.2 t -51.49 139.94 6.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.14 -0.482 . . . . 73.22 111.101 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -94.77 75.42 3.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.476 . . . . 74.45 110.867 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -46.92 -34.58 5.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 65.43 111.127 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -57.94 -45.19 86.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 74.53 110.903 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -69.67 114.82 8.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 74.53 110.903 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.08 -23.98 37.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.214 -0.448 . . . . 74.02 110.858 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -66.81 -57.68 6.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 74.21 110.843 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -57.64 -57.59 12.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 73.11 110.944 -179.96 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.7 p -51.43 -32.12 12.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 74.53 111.162 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.7 mtm -68.17 -51.64 43.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.476 . . . . 75.23 110.852 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.9 mttm -55.83 -42.67 76.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 74.02 110.904 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.6 mp -64.79 -55.04 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 53.03 111.149 179.857 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 90.5 mt -57.7 -37.53 59.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 74.34 111.087 179.889 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -71.08 -52.02 21.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 73.42 110.896 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -58.94 -51.35 70.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 65.34 110.844 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -68.66 -14.1 62.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.145 -0.479 . . . . 71.53 110.883 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? 58.76 54.23 5.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 74.51 110.914 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 22.6 mt -81.74 131.19 58.3 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.655 0.74 . . . . 75.24 111.134 179.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 158.23 57.66 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.685 2.257 . . . . 74.5 112.363 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -85.37 169.94 13.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 74.2 111.164 -179.957 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 25.4 t -51.51 -52.04 22.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 71.33 111.116 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -59.87 -47.48 85.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 60.24 110.891 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -57.48 -27.84 62.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.127 -0.488 . . . . 74.54 110.94 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 26.8 t90 -73.27 -48.01 38.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 73.52 110.94 179.968 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 11.6 mtmt -64.86 -39.97 94.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.219 -0.446 . . . . 75.13 110.905 179.931 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -70.23 -43.51 70.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.464 . . . . 72.32 110.867 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 39.7 mm-40 -61.37 -45.96 92.19 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.18 -0.464 . . . . 72.11 110.917 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.3 p -68.67 -40.92 79.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 74.4 111.141 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.2 mmt85 -62.96 -37.46 87.17 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.178 -0.465 . . . . 72.23 110.899 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -84.62 -23.96 29.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 74.15 110.88 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -82.84 -23.45 33.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.183 -0.462 . . . . 74.43 110.898 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 2.9 mptp? -97.02 -18.87 19.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.125 -0.489 . . . . 74.42 110.946 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -53.86 174.91 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.461 . . . . 73.22 110.9 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.3 m 63.38 42.35 6.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.156 -0.474 . . . . 74.51 110.87 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 16.0 m -74.66 -168.94 0.77 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.118 -0.492 . . . . 74.21 110.888 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 10.3 mt -79.86 158.66 4.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.151 -0.477 . . . . 75.41 111.154 179.928 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.6 pt20 -48.86 157.54 0.39 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 52.34 110.9 179.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -147.19 179.93 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.454 . . . . 73.14 111.124 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -54.51 -77.79 0.14 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.772 -0.728 . . . . 74.33 112.473 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -113.9 150.05 34.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.862 0.363 . . . . 73.13 110.908 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -156.98 -120.75 0.65 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.74 -0.743 . . . . 75.22 112.477 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -54.41 171.04 0.13 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.823 0.344 . . . . 74.31 110.845 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -160.05 167.52 35.47 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.725 -0.75 . . . . 60.33 112.491 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -51.34 134.43 28.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.798 0.332 . . . . 72.53 110.901 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 7.4 p -99.45 -177.92 3.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.437 . . . . 72.11 110.826 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -147.78 149.44 32.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.094 -0.503 . . . . 74.33 110.891 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -111.03 132.54 11.0 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.757 -0.735 . . . . 53.42 112.522 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -102.72 -65.03 1.02 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.804 0.335 . . . . 65.42 110.931 -179.927 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 14.3 tm-20 . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.128 -0.487 . . . . 72.32 110.891 179.937 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.353 0 N-CA-C 112.521 -0.231 . . . . 74.43 112.521 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -92.66 -45.61 7.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.813 0.34 . . . . 74.22 110.913 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 28.8 m-85 -84.79 -75.04 0.37 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 73.25 110.837 179.978 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 27.9 mm 51.39 76.21 0.57 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.573 0.701 . . . . 72.2 111.153 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 104.58 1.34 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.693 2.262 . . . . 75.44 112.354 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 31.0 t -96.47 5.08 51.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 54.41 110.829 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -51.68 162.15 0.78 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.637 0.732 . . . . 74.32 110.891 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -19.09 36.76 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.669 2.246 . . . . 74.11 112.357 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 63.69 82.6 0.21 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.628 0.728 . . . . 74.43 111.117 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 140.75 43.47 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.681 2.254 . . . . 53.11 112.349 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 26.3 mtmm -72.14 160.72 81.95 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.582 0.706 . . . . 75.11 110.889 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 167.75 23.54 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.704 2.269 . . . . 74.32 112.329 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 86.5 0.58 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.638 2.226 . . . . 65.45 112.367 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 61.4 p -91.07 -175.75 4.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 71.34 110.858 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.2 -33.67 20.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.112 -0.495 . . . . 51.52 110.874 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 74.41 111.082 179.91 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.763 0.316 . . . . 70.31 110.88 . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -104.12 160.38 26.26 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.562 0.696 . . . . 75.14 111.113 179.921 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 131.97 22.37 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.684 2.256 . . . . 70.54 112.342 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.5 pp -134.18 145.35 49.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.214 -0.448 . . . . 73.23 110.885 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -128.97 148.17 50.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 73.41 110.902 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -122.7 168.6 12.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.137 -0.483 . . . . 73.25 111.09 179.939 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.4 p -134.27 130.17 54.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 75.13 111.127 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -72.74 142.47 48.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 73.43 111.143 -179.977 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 5.7 mt -117.6 -17.1 10.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.452 . . . . 73.22 110.91 179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -129.29 167.95 16.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.178 -0.465 . . . . 74.14 110.949 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -92.14 112.19 24.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.119 -0.491 . . . . 74.24 110.868 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -92.17 123.16 35.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.129 -0.487 . . . . 72.01 110.92 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.9 mttt -101.96 101.01 11.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 75.23 110.958 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.17 155.65 20.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.439 . . . . 72.3 111.109 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -122.72 -35.99 2.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 75.22 110.841 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -121.67 -176.49 3.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.156 -0.475 . . . . 73.13 110.844 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -68.23 -38.45 81.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 65.11 110.855 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -63.7 -32.95 74.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 73.44 110.846 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -79.3 147.71 32.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.436 . . . . 75.34 110.846 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 8.7 tp -127.5 121.6 31.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.113 -0.494 . . . . 74.14 110.909 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -77.32 144.07 38.32 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.236 -0.438 . . . . 72.22 110.882 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.0 p -149.89 154.71 8.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 72.53 111.176 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.0 m -105.84 156.14 37.11 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.715 0.769 . . . . 74.44 110.864 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.86 139.88 40.96 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.703 2.269 . . . . 74.21 112.341 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.35 -4.99 74.32 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.741 -0.742 . . . . 64.04 112.461 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -89.54 146.08 24.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.868 0.366 . . . . 74.34 110.918 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -89.76 123.7 33.99 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 65.41 110.884 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -116.08 145.64 42.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 73.42 110.877 179.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.2 t -101.24 112.89 25.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.154 -0.475 . . . . 53.33 110.862 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 56.6 mt -78.36 144.57 11.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.099 -0.5 . . . . 74.42 111.141 179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.2 m -117.95 -41.94 2.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.18 -0.464 . . . . 73.4 110.837 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.37 175.35 14.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 64.51 111.081 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.4 p80 -127.22 178.52 5.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 75.44 110.838 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -150.88 107.22 3.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.212 -0.449 . . . . 74.43 110.951 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 57.62 20.07 5.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.143 -0.481 . . . . 73.41 110.906 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 32.7 m-85 58.84 21.88 9.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 72.33 110.912 -179.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -118.17 -24.81 6.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 74.32 110.866 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -130.23 135.87 48.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 74.01 110.903 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -118.56 138.79 52.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.254 -0.43 . . . . 74.44 110.859 -179.942 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.2 mm -93.77 94.17 4.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 71.45 111.119 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -109.97 149.64 29.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 75.53 111.11 179.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.2 pttp -124.9 158.01 64.42 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.576 0.703 . . . . 75.12 110.913 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 153.94 68.29 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.671 2.248 . . . . 73.11 112.343 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 29.0 mt -120.03 -9.51 10.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 72.12 111.118 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' A ASN . . . . . . . . . . . . . 27.7 m-20 -118.1 -49.36 2.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 72.33 110.874 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' B ARG . . . . . . . . . . . . . 1.2 mtm105 -51.52 -70.02 0.1 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 74.21 110.878 179.991 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 5.5 mp -151.64 -75.8 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 75.33 110.903 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 142.08 66.04 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.808 -0.71 . . . . 73.43 112.538 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -122.51 154.49 16.94 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.756 -0.735 . . . . 71.12 112.51 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 114.19 3.62 Favored 'Trans proline' 0 N--CA 1.465 -0.16 0 C-N-CA 122.719 2.279 . . . . 74.32 112.351 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -121.79 163.69 15.15 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.697 -0.763 . . . . 72.24 112.476 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -108.89 124.68 51.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.853 0.359 . . . . 73.3 110.933 -179.938 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.2 p -143.3 133.21 11.94 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.665 0.745 . . . . 71.02 111.119 179.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.76 152.42 69.29 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.707 2.271 . . . . 75.35 112.284 179.995 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 12.4 t -64.92 -20.75 28.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 64.24 111.132 179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.6 m -79.56 0.41 29.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 74.41 110.837 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 27.5 m-85 -127.63 18.61 6.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 72.2 110.926 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.5 m -151.9 160.29 3.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.097 -0.501 . . . . 74.43 111.109 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.1 ttp180 -123.62 129.43 51.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 74.15 110.885 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 44.6 mm -81.89 111.95 19.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 72.43 111.169 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 13.6 pt -129.98 -178.28 2.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 70.21 111.125 179.903 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -129.15 129.63 45.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.189 -0.46 . . . . 75.31 110.85 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.4 mt -55.19 -26.2 37.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 73.4 110.89 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.51 -30.77 16.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 73.15 110.873 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -141.05 73.92 26.03 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.578 0.704 . . . . 75.45 110.862 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 -13.77 35.02 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.66 2.24 . . . . 75.11 112.312 -179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.99 -16.14 20.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.237 -0.438 . . . . 64.03 111.122 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.9 ttmt -74.26 -52.17 13.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 75.13 110.89 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 68.0 m-85 -95.41 23.17 6.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.195 -0.457 . . . . 73.01 110.931 -179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -87.0 -18.76 29.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 73.55 111.068 179.891 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.3 p -95.93 -21.22 18.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.24 -0.436 . . . . 74.53 110.825 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 9.6 p -51.45 145.54 2.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.138 -0.483 . . . . 73.22 111.107 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.44 106.43 18.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.173 -0.467 . . . . 72.04 110.852 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -70.59 -35.79 73.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 74.45 111.097 -179.861 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -60.66 -41.52 95.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.186 -0.461 . . . . 70.42 110.928 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 57.4 t0 -63.94 107.85 1.34 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.138 -0.483 . . . . 74.52 110.854 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.15 -27.08 31.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 73.11 110.868 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -67.15 -55.26 14.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 73.44 110.912 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -59.71 -56.58 20.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 73.12 110.879 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 2.4 p -52.81 -31.7 16.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 62.33 111.131 179.987 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 11.4 mtm -68.02 -56.08 10.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 74.23 110.932 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 41.1 mttm -54.84 -36.96 65.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 75.44 110.919 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 27.0 mt -66.91 -55.18 18.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 72.25 111.116 179.867 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 96.9 mt -60.57 -36.05 67.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.461 . . . . 73.14 111.092 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -71.27 -50.17 35.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 74.53 110.864 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -62.82 -47.04 85.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 75.31 110.884 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -70.72 -14.08 62.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 74.33 110.908 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.85 54.94 4.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.483 . . . . 74.44 110.856 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 49.9 mt -85.12 132.18 46.27 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.602 0.715 . . . . 64.52 111.125 179.844 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 161.07 47.36 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.671 2.247 . . . . 72.53 112.361 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -97.31 165.67 11.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.248 -0.433 . . . . 73.42 111.203 179.989 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 87.2 t -50.84 -52.66 16.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.262 -0.427 . . . . 72.13 111.112 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -52.22 -52.17 53.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 75.34 110.931 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -58.04 -42.75 86.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.148 -0.478 . . . . 74.43 110.912 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 55.5 t90 -65.32 -36.26 83.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.219 -0.446 . . . . 73.12 110.94 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? -68.29 -37.82 81.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 72.32 110.907 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -69.81 -50.52 42.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 74.52 110.885 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -59.89 -39.66 86.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 74.35 110.901 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 30.8 p -70.43 -41.1 73.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 74.24 111.163 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -60.9 -45.26 95.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 73.12 110.915 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -75.67 -31.11 59.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.48 . . . . 74.44 110.839 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 50.1 t80 -71.77 -38.69 70.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.225 -0.443 . . . . 72.31 110.891 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.6 mtpp -66.68 -14.48 62.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.13 -0.486 . . . . 75.11 110.881 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -60.17 -169.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.282 -0.417 . . . . 74.44 110.842 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 88.1 p -48.96 105.55 0.08 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.485 . . . . 73.13 110.843 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 4.3 m -158.18 -169.3 2.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.116 -0.493 . . . . 73.33 110.867 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 19.6 mt -73.63 156.49 6.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 72.15 111.134 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 22.4 mt-30 -49.42 166.41 0.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 65.01 110.934 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 25.3 mm -137.07 -69.12 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.219 -0.446 . . . . 75.22 111.114 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 153.01 -33.8 0.79 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.76 -0.733 . . . . 65.32 112.515 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -119.42 149.93 41.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.881 0.372 . . . . 75.31 110.905 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -152.57 145.62 13.37 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.696 -0.764 . . . . 61.25 112.468 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 29.3 m80 -153.66 -179.47 7.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.783 0.325 . . . . 65.12 110.911 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 174.03 145.02 5.03 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.761 -0.733 . . . . 75.0 112.492 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -146.74 179.88 7.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.802 0.334 . . . . 73.41 110.93 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 35.4 m -163.05 157.97 21.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 75.22 110.871 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -148.19 178.62 8.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.164 -0.471 . . . . 72.33 110.923 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 154.94 117.66 0.61 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.768 -0.73 . . . . 63.54 112.486 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -165.06 158.24 16.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.806 0.336 . . . . 73.53 110.875 -179.91 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.149 -0.478 . . . . 71.22 110.897 179.902 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 N-CA-C 112.476 -0.25 . . . . 75.44 112.476 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 22.8 mtpt -86.14 -39.2 16.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.842 0.354 . . . . 75.21 110.909 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -94.27 -76.58 0.48 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.45 . . . . 73.43 110.896 179.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 22.1 mm 50.25 78.22 0.41 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.611 0.719 . . . . 74.4 111.14 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 97.09 0.62 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.661 2.241 . . . . 64.44 112.337 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 28.7 t -95.99 3.28 53.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.197 -0.456 . . . . 70.14 110.863 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.54 162.39 0.71 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.637 0.732 . . . . 74.3 110.874 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 -17.94 37.17 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.674 2.249 . . . . 71.52 112.322 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 63.89 84.04 0.19 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.618 0.723 . . . . 70.11 111.097 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 140.01 41.79 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.696 2.264 . . . . 74.13 112.36 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -73.6 160.59 81.87 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.602 0.715 . . . . 73.04 110.909 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 167.1 25.47 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.667 2.245 . . . . 74.22 112.323 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.7 -31.41 20.86 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 122.703 2.269 . . . . 75.52 112.401 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 19.4 m -97.47 64.32 1.84 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 74.01 110.831 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 7.3 t -70.3 127.23 32.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.14 -0.482 . . . . 64.21 110.854 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.494 . . . . 55.32 111.071 179.937 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.76 0.314 . . . . 72.11 110.903 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -137.33 160.37 65.84 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.566 0.698 . . . . 71.01 111.071 179.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 140.84 43.65 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.715 2.277 . . . . 64.42 112.324 -179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.1 pp -140.41 147.27 39.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 75.32 110.924 -179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -126.03 156.65 39.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 72.4 110.848 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -133.43 156.05 48.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 63.0 111.088 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 p -123.36 121.63 63.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 73.44 111.187 179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -64.95 140.73 58.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 75.33 111.169 -179.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 8.2 mt -116.71 -13.87 10.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.262 -0.426 . . . . 73.32 110.923 179.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -134.98 158.58 43.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.172 -0.467 . . . . 74.01 110.939 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.56 105.22 14.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.117 -0.492 . . . . 72.21 110.897 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -86.64 132.86 33.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.159 -0.473 . . . . 74.43 110.904 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.01 98.61 7.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 64.2 110.873 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.13 159.45 1.25 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.426 . . . . 75.51 111.096 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -116.4 -23.93 8.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 74.45 110.895 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.5 mmm-85 -141.14 -177.51 5.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 74.32 110.86 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -58.18 -46.08 86.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 70.21 110.875 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -52.32 -52.65 51.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 74.25 110.844 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.9 mp0 -67.01 151.16 48.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 52.33 110.872 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.0 tp -125.87 151.71 46.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.155 -0.475 . . . . 75.23 110.886 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -95.13 142.25 27.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 74.33 110.867 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.6 p -152.45 150.14 13.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.18 -0.464 . . . . 74.13 111.128 179.998 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.3 m -105.96 159.64 28.94 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.682 0.753 . . . . 73.23 110.84 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.68 121.82 8.52 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.732 2.288 . . . . 70.41 112.363 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.13 1.77 31.58 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.68 -0.771 . . . . 71.11 112.483 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -92.14 156.96 16.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.855 0.359 . . . . 72.01 110.869 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -100.88 131.69 46.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.48 . . . . 72.41 110.921 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.7 mp -130.83 146.27 52.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.207 -0.451 . . . . 73.24 110.896 -179.996 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.14 115.97 31.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 72.12 110.876 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 43.9 mt -80.8 150.46 4.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 74.52 111.12 179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 24.7 m -123.93 -41.7 2.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 55.43 110.868 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -154.63 -178.42 7.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 73.14 111.124 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.8 p80 -134.62 175.25 9.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 73.45 110.858 -179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 33.4 t80 -137.39 100.29 4.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.233 -0.44 . . . . 73.54 110.929 -179.871 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 55.58 25.63 8.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.098 -0.501 . . . . 75.44 110.886 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 63.61 16.4 9.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 73.32 110.935 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -104.03 -54.89 2.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.123 -0.489 . . . . 65.34 110.886 -179.99 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 39.1 m95 -105.65 151.7 24.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.156 -0.475 . . . . 75.14 110.935 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -124.75 135.89 53.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 72.33 110.874 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.7 mm -93.13 95.98 5.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 74.51 111.136 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -113.79 153.96 28.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 71.1 111.109 179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 ptmt -126.73 157.6 70.76 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.568 0.699 . . . . 74.31 110.882 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 130.92 20.22 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.666 2.244 . . . . 75.33 112.346 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 76.9 mt -98.76 -38.18 6.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.427 . . . . 73.51 111.11 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' A ASN . . . . . . . . . . . . . 40.1 t-20 -101.68 -36.5 8.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 73.3 110.893 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' B ARG . . . . . . . . . . . . . 5.0 mmp_? -71.18 -176.96 1.57 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 74.4 110.84 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.2 mm? -128.15 121.8 30.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 74.22 110.907 -179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 172.03 -107.65 0.26 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.726 -0.75 . . . . 63.24 112.501 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -173.63 172.91 45.58 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.74 -0.743 . . . . 74.45 112.487 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.81 124.74 11.36 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.694 2.263 . . . . 73.23 112.304 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -116.11 -122.46 3.44 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.728 -0.749 . . . . 31.11 112.471 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -153.69 124.79 7.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.837 0.351 . . . . 72.43 110.932 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.0 p -134.87 132.76 20.6 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.646 0.736 . . . . 74.21 111.152 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.7 150.49 68.67 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.711 2.274 . . . . 74.42 112.381 179.944 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 52.9 t -58.17 -22.6 19.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 75.51 111.134 179.889 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -77.93 -3.89 44.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 74.0 110.829 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 14.9 m-85 -122.25 18.6 10.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.465 . . . . 73.23 110.935 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 3.8 m -153.92 140.07 11.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 71.32 111.097 179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.2 ttm180 -112.87 117.01 30.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 71.52 110.861 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 31.3 mm -66.84 109.18 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.206 -0.452 . . . . 74.5 111.129 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 3.5 pt -130.91 170.09 20.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 74.41 111.18 179.825 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -114.41 141.24 47.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.197 -0.456 . . . . 73.12 110.846 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.29 -24.99 66.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 64.24 110.92 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.85 -28.98 17.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 74.13 110.87 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -148.73 73.6 10.47 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.59 0.709 . . . . 73.23 110.839 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 -10.87 29.59 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.709 2.273 . . . . 73.31 112.331 -179.961 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.69 -12.67 33.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 72.41 111.095 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.6 ttmm -74.44 -52.06 13.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.459 . . . . 75.54 110.905 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 73.4 m-85 -98.38 23.11 8.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 74.53 110.926 -179.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -81.43 -21.97 38.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.108 -0.497 . . . . 65.41 111.08 179.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.2 t -96.96 -12.68 23.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 65.2 110.829 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 55.4 t -51.44 141.73 4.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 63.1 111.157 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -91.35 76.13 5.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.173 -0.467 . . . . 74.1 110.875 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -47.51 -34.91 8.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.185 -0.462 . . . . 72.14 111.143 -179.864 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -60.17 -44.24 95.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 71.13 110.953 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -63.87 113.47 3.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.088 -0.506 . . . . 73.44 110.886 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.06 -24.13 37.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 74.1 110.866 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -66.3 -57.4 7.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 72.25 110.895 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -57.61 -56.07 26.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 65.35 110.913 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -53.41 -31.32 18.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 74.21 111.128 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 7.8 mtm -68.35 -55.54 11.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.484 . . . . 74.31 110.863 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 48.2 mttt -54.53 -39.04 67.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.262 -0.426 . . . . 74.13 110.894 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 70.4 mt -65.71 -58.22 7.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 71.33 111.079 179.905 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 97.8 mt -57.79 -35.17 50.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 73.42 111.127 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -70.77 -52.01 23.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.153 -0.476 . . . . 65.32 110.836 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -61.28 -49.4 77.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 74.31 110.892 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -68.9 -14.5 63.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 74.51 110.881 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.65 55.57 4.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 72.15 110.902 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 39.0 mt -84.9 132.07 47.11 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 121.671 0.748 . . . . 73.02 111.16 179.84 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 151.33 68.78 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.634 2.223 . . . . 74.3 112.389 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -85.55 168.29 14.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.43 . . . . 73.15 111.167 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 71.1 t -51.66 -58.12 2.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 74.03 111.108 179.947 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -52.02 -51.65 55.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 75.43 110.874 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 40.1 mm-40 -57.02 -41.07 77.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.156 -0.475 . . . . 74.32 110.878 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 34.8 t90 -66.93 -38.02 85.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.251 -0.431 . . . . 73.22 110.932 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -68.12 -35.47 78.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 74.21 110.926 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -71.79 -49.85 35.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 61.54 110.912 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 21.0 pt20 -61.03 -39.93 91.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 75.54 110.891 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 38.8 p -70.9 -42.64 69.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 74.31 111.157 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 1.1 mmm180 -62.2 -38.82 90.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 75.23 110.896 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 59.4 mtp180 -80.61 -30.25 36.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 73.41 110.851 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -78.32 -22.54 47.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 74.25 110.934 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 11.7 mmmt -91.46 -23.7 19.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.09 -0.504 . . . . 75.43 110.896 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -89.25 9.43 25.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.21 -0.45 . . . . 75.32 110.917 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.5 m 51.48 47.72 24.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.098 -0.501 . . . . 75.53 110.855 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 90.0 p -70.99 -169.02 0.32 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 74.23 110.881 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 9.5 mt -79.99 158.78 4.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.16 -0.473 . . . . 74.45 111.123 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 6.8 pt20 -49.69 166.7 0.05 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 72.24 110.916 179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.1 mp -119.34 -60.61 2.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 71.4 111.144 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -157.28 57.71 0.37 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.741 -0.742 . . . . 73.05 112.494 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -88.77 122.26 31.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.88 0.371 . . . . 71.35 110.935 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 164.46 151.92 6.75 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.789 -0.72 . . . . 75.51 112.534 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -172.79 154.76 3.03 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.775 0.321 . . . . 75.31 110.903 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -102.13 -157.65 26.19 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.779 -0.724 . . . . 75.24 112.508 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -173.85 141.46 0.81 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.85 0.357 . . . . 72.03 110.898 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 64.2 m -78.92 -176.05 4.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 75.11 110.865 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -144.54 143.55 30.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 75.04 110.946 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -131.84 115.79 1.75 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.718 -0.754 . . . . 74.32 112.512 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -153.53 174.3 14.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.794 0.33 . . . . 74.32 110.867 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 74.12 110.915 179.946 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 N-CA-C 112.455 -0.258 . . . . 61.14 112.455 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -156.29 175.58 13.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.766 0.317 . . . . 74.34 110.924 -179.966 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 59.82 26.33 15.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.243 -0.435 . . . . 72.35 110.863 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 3.0 mp -78.26 116.47 59.28 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.608 0.718 . . . . 75.44 111.141 179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 -49.58 0.55 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.679 2.253 . . . . 74.54 112.366 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 1.2 t 49.61 32.36 4.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.46 . . . . 72.31 110.877 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -116.31 162.56 25.69 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.598 0.713 . . . . 74.22 110.872 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.68 -18.19 37.5 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.714 2.276 . . . . 73.11 112.355 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 65.92 146.15 0.1 OUTLIER Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.593 0.711 . . . . 70.13 111.08 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.79 153.49 68.72 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.674 2.249 . . . . 63.31 112.362 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 5.2 mtmp? -100.4 161.17 24.92 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.598 0.713 . . . . 71.34 110.894 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 165.31 31.38 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.664 2.243 . . . . 63.32 112.356 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 88.01 0.54 Allowed 'Trans proline' 0 C--N 1.341 0.14 0 C-N-CA 122.678 2.252 . . . . 74.24 112.321 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 1.3 m -113.06 74.15 0.85 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 75.15 110.838 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 77.8 p -82.66 -175.17 5.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.121 -0.49 . . . . 61.41 110.828 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.12 -0.491 . . . . 74.41 111.126 179.901 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.797 0.332 . . . . 75.23 110.862 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -136.97 160.44 66.17 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.518 0.675 . . . . 75.24 111.137 179.878 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 126.61 13.47 Favored 'Trans proline' 0 C--O 1.231 0.155 0 C-N-CA 122.66 2.24 . . . . 74.53 112.366 -179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -118.36 156.28 29.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 75.33 110.939 -179.983 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -130.15 150.65 51.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 73.34 110.866 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -135.04 144.86 47.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.154 -0.476 . . . . 64.01 111.102 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 10.0 p -114.58 129.38 70.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 75.11 111.131 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -69.17 132.3 46.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.47 . . . . 74.31 111.119 -179.997 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.8 mt -100.73 -20.94 15.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 74.22 110.918 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -129.25 168.62 15.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.472 . . . . 71.03 110.942 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -88.91 104.89 17.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.479 . . . . 73.22 110.899 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 16.7 t80 -91.46 104.42 16.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 72.42 110.886 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.6 mmtp -84.96 106.44 16.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 72.55 110.909 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.24 158.74 3.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.225 -0.443 . . . . 64.21 111.116 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -128.49 -39.2 1.68 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.23 -0.441 . . . . 74.52 110.863 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 16.0 mmm180 -108.28 178.86 4.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 75.22 110.854 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -67.27 -36.38 81.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.193 -0.458 . . . . 71.05 110.833 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -68.76 -49.14 61.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 75.54 110.903 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -57.04 135.45 56.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.22 -0.445 . . . . 70.31 110.88 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.0 tp -112.13 129.77 56.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 73.44 110.91 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.01 142.1 45.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 74.3 110.846 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 6.4 p -152.82 144.61 15.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.198 -0.456 . . . . 62.22 111.135 -179.989 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.3 m -105.47 160.52 25.77 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.668 0.746 . . . . 74.34 110.89 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 122.23 8.92 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.694 2.263 . . . . 73.15 112.38 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.09 5.53 30.53 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.765 -0.731 . . . . 70.12 112.473 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 13.8 mt-10 -92.3 161.08 14.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.82 0.343 . . . . 74.43 110.91 -179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -107.83 127.03 53.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.195 -0.457 . . . . 75.22 110.894 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.1 mt -129.7 146.5 51.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 74.42 110.919 179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.7 t -104.86 112.54 25.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 61.11 110.887 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 58.1 mt -81.92 145.41 8.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.128 -0.487 . . . . 75.21 111.147 179.953 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 80.8 m -117.27 -33.41 4.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 54.43 110.869 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -161.04 173.57 15.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 71.44 111.102 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -122.84 177.95 5.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 73.21 110.845 -179.963 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -141.94 99.95 3.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 74.43 110.934 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.3 t0 54.61 22.82 4.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.087 -0.506 . . . . 74.45 110.911 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.1 m-85 63.74 15.42 8.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 72.04 110.925 -179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -103.46 -40.89 6.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.07 -0.514 . . . . 65.0 110.897 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -122.24 164.22 18.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.194 -0.457 . . . . 74.54 110.902 -179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -134.63 130.5 36.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 74.35 110.857 -179.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 8.5 mm -92.39 94.29 4.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 74.43 111.146 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -124.59 164.49 19.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.191 -0.459 . . . . 71.54 111.099 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.9 pttm -127.43 157.25 73.42 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.521 0.677 . . . . 64.32 110.926 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 138.12 37.2 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.683 2.256 . . . . 74.32 112.32 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 60.5 mt -106.17 -43.25 7.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 73.43 111.15 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' A ASN . . . . . . . . . . . . . 18.0 t-20 -63.19 -50.7 69.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.205 -0.452 . . . . 64.23 110.879 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' B ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.25 -177.49 3.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.168 -0.469 . . . . 74.44 110.893 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 9.6 mt -120.88 119.41 32.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.449 . . . . 72.32 110.898 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -148.78 -52.26 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.751 -0.737 . . . . 42.54 112.481 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 133.69 167.27 11.56 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.808 -0.71 . . . . 74.41 112.522 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 116.62 4.65 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.619 2.212 . . . . 64.11 112.363 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -115.83 -130.71 4.72 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.702 -0.761 . . . . 73.24 112.487 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -144.18 127.05 16.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.861 0.363 . . . . 75.54 110.913 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.2 p -135.13 129.85 19.09 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.672 0.749 . . . . 74.35 111.135 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.68 161.72 44.82 Favored 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.677 2.251 . . . . 72.23 112.346 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.0 t -83.06 -21.74 8.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.238 -0.437 . . . . 71.53 111.139 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.2 m -75.98 -4.7 42.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.124 -0.489 . . . . 74.25 110.888 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -126.16 -0.82 7.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.128 -0.487 . . . . 74.24 110.939 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -125.37 147.87 29.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.144 -0.48 . . . . 73.14 111.133 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.7 ttp180 -123.63 110.6 15.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 73.43 110.814 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.7 mp -65.76 111.44 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 74.45 111.146 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 3.5 pt -127.64 141.69 45.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 71.42 111.107 179.885 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -70.43 123.83 22.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 74.34 110.895 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.0 tp -56.35 -24.93 47.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 75.42 110.92 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.01 -29.38 16.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 74.51 110.878 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -143.09 78.49 15.14 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.618 0.723 . . . . 75.34 110.841 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 -7.36 20.85 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.668 2.245 . . . . 73.31 112.339 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.11 -7.58 38.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.435 . . . . 75.03 111.047 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -84.4 -52.22 6.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.3 -0.409 . . . . 75.35 110.863 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 12.9 m-85 -97.48 23.88 7.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 73.05 110.914 -179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -85.41 -19.2 31.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 74.04 111.118 179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 90.4 p -92.58 -24.13 18.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.237 -0.438 . . . . 65.42 110.859 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 9.0 p -52.07 155.56 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.477 . . . . 74.0 111.14 179.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -110.61 94.98 5.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.195 -0.457 . . . . 75.03 110.871 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -58.44 -38.64 77.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.175 -0.466 . . . . 70.55 111.119 -179.867 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -55.1 -44.26 74.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.252 -0.431 . . . . 75.13 110.917 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -63.74 110.04 1.91 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.134 -0.485 . . . . 52.52 110.88 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.57 -28.69 21.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 73.44 110.878 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -66.97 -56.74 8.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 72.33 110.892 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -58.64 -55.15 38.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 74.11 110.89 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 5.5 p -53.92 -33.22 23.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 75.23 111.09 -179.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 14.5 mtm -67.14 -53.5 30.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.231 -0.44 . . . . 74.02 110.834 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.1 mttm -56.18 -37.4 69.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 75.41 110.925 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 17.3 mt -66.77 -52.62 43.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 74.3 111.102 179.906 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 90.6 mt -63.25 -33.86 63.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 72.31 111.096 179.872 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -71.11 -46.2 62.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 71.0 110.885 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -68.53 -48.43 64.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.465 . . . . 73.42 110.844 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -68.75 -15.35 63.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.134 -0.485 . . . . 73.15 110.839 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt 59.95 49.56 7.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.147 -0.479 . . . . 70.2 110.884 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 24.5 mt -78.23 131.53 68.94 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.598 0.714 . . . . 72.43 111.177 179.89 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 164.32 34.97 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.701 2.268 . . . . 75.24 112.307 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -95.41 170.2 9.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.2 -0.455 . . . . 75.53 111.19 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 68.6 t -55.81 -54.65 24.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.272 -0.422 . . . . 64.1 111.122 179.955 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -51.95 -50.58 60.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 74.11 110.893 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -57.74 -44.39 86.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.489 . . . . 73.22 110.894 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 23.0 t90 -61.68 -43.0 99.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.208 -0.451 . . . . 73.21 110.921 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 5.1 mmpt? -60.65 -53.25 59.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 73.34 110.884 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -59.98 -37.82 80.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 74.35 110.904 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -61.06 -53.03 62.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.481 . . . . 73.51 110.904 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -61.85 -43.24 99.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 62.24 111.15 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 13.5 mtt180 -59.74 -60.96 3.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.45 . . . . 73.24 110.874 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 52.9 mtp180 -55.91 -36.92 68.22 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 74.24 110.856 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -61.4 -47.41 85.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.44 . . . . 74.15 110.9 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 8.4 mmmt -74.92 -25.07 58.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.155 -0.475 . . . . 72.23 110.9 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.74 167.83 2.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 74.51 110.897 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.0 p -91.72 169.06 11.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 74.31 110.868 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 15.1 m -85.02 -167.89 2.0 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 63.32 110.881 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.3 mt -83.92 160.23 3.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.469 . . . . 72.22 111.127 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 8.8 pm0 -49.22 165.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.452 . . . . 73.41 110.917 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 21.9 mm -115.56 -24.78 3.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.239 -0.437 . . . . 74.02 111.134 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -101.29 -140.27 11.15 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.772 -0.728 . . . . 72.51 112.487 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -112.84 117.55 32.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.923 0.392 . . . . 61.53 110.894 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -82.0 143.59 23.25 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.709 -0.758 . . . . 75.45 112.457 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 10.2 m-70 -78.78 177.74 8.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.877 0.37 . . . . 74.2 110.832 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -80.86 137.93 18.68 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.751 -0.738 . . . . 74.4 112.484 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -131.33 179.01 6.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.774 0.321 . . . . 71.1 110.902 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 2.1 p -150.25 153.86 36.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 72.51 110.86 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -133.1 173.26 11.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.157 -0.474 . . . . 73.12 110.913 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -85.45 90.73 1.66 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.748 -0.739 . . . . 31.21 112.508 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 19.5 mt -124.51 -73.9 0.63 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.814 0.34 . . . . 75.45 110.875 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 63.33 110.823 180.0 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 N-CA-C 112.521 -0.232 . . . . 64.21 112.521 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.08 -38.88 2.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.811 0.339 . . . . 71.24 110.871 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -74.38 -74.73 0.18 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.216 -0.447 . . . . 71.34 110.948 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 26.8 mm 53.06 76.31 0.54 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.653 0.739 . . . . 73.02 111.163 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.67 78.42 0.98 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.704 2.269 . . . . 75.32 112.386 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 14.5 t -81.13 -0.52 40.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 73.43 110.824 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 24.5 mmt180 -48.91 161.21 0.43 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.575 0.702 . . . . 74.23 110.874 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 -26.21 27.62 Favored 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.677 2.251 . . . . 64.35 112.344 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.29 85.84 0.15 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.591 0.71 . . . . 72.35 111.08 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 158.38 57.09 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.622 2.215 . . . . 75.53 112.367 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.94 160.45 33.79 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.582 0.706 . . . . 75.12 110.894 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 167.48 24.34 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.674 2.25 . . . . 74.52 112.345 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 119.87 6.75 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.645 2.23 . . . . 75.21 112.37 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 17.3 m -62.8 162.65 10.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 75.14 110.871 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 7.8 t -127.59 -45.62 1.47 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.153 -0.476 . . . . 75.44 110.865 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 71.41 111.094 179.909 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 21.3 ptm . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.783 0.325 . . . . 74.03 110.864 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -149.22 159.84 36.07 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.657 0.741 . . . . 71.23 111.072 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 78.42 1.02 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.694 2.263 . . . . 74.03 112.332 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -90.98 145.45 24.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 74.0 110.937 179.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -123.26 142.84 50.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.466 . . . . 72.14 110.875 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -122.76 150.49 42.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 73.2 111.057 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.1 p -116.07 129.08 73.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.176 -0.465 . . . . 74.43 111.127 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.39 132.46 47.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.453 . . . . 75.24 111.153 -179.957 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 7.1 mt -102.71 -16.81 15.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.208 -0.451 . . . . 74.25 110.909 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -136.49 161.99 34.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.474 . . . . 71.42 110.924 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -86.87 114.26 23.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.086 -0.506 . . . . 72.23 110.865 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -100.2 130.08 46.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.115 -0.493 . . . . 73.34 110.88 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -104.21 109.36 21.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.12 -0.491 . . . . 74.32 110.913 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.86 159.58 16.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 73.43 111.114 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -116.57 -28.44 6.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 74.24 110.89 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -141.46 -174.52 4.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 74.3 110.846 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -64.71 -39.19 93.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.172 -0.467 . . . . 74.52 110.824 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -62.86 -18.4 62.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.222 -0.445 . . . . 75.13 110.85 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -110.2 140.12 44.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 73.33 110.912 -179.904 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.6 tp -114.57 153.77 29.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 74.44 110.898 -179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -97.78 126.77 43.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.476 . . . . 62.34 110.864 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -125.51 159.29 33.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.246 -0.433 . . . . 74.33 111.16 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.4 m -124.27 159.25 58.01 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.654 0.74 . . . . 73.43 110.799 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 118.48 5.71 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.656 2.238 . . . . 73.22 112.329 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.02 -0.34 31.6 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.758 -0.734 . . . . 63.25 112.504 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -89.25 151.37 22.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.863 0.363 . . . . 74.44 110.888 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 10.5 m120 -96.61 112.63 24.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.136 -0.483 . . . . 65.43 110.881 -179.91 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -112.25 142.04 45.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.193 -0.458 . . . . 73.12 110.905 179.978 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.72 112.48 24.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 71.32 110.85 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 31.3 mm -66.94 144.89 14.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 71.43 111.117 179.982 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.5 m -122.46 -42.09 2.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.169 -0.469 . . . . 74.21 110.904 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -171.77 168.97 6.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 62.54 111.117 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.1 p80 -119.45 178.31 4.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 65.43 110.861 179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -148.69 105.7 3.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 71.01 110.854 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 56.54 22.52 6.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.084 -0.507 . . . . 75.43 110.866 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 16.5 m-85 57.78 22.78 8.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 74.51 110.939 -179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -121.06 -5.47 9.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.119 -0.491 . . . . 74.31 110.935 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -152.51 158.8 43.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.11 -0.495 . . . . 74.11 110.89 179.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -141.55 151.67 43.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.458 . . . . 72.34 110.888 -179.972 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 6.3 mm -109.49 94.03 2.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.191 -0.459 . . . . 73.51 111.121 179.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -107.25 146.03 31.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 75.24 111.159 179.78 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -118.0 155.56 51.07 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.584 0.706 . . . . 75.51 110.93 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 123.7 10.35 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.66 2.24 . . . . 73.22 112.329 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 69.5 mt -78.04 -46.23 26.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 70.24 111.123 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' A ASN . . . . . . . . . . . . . 15.7 m120 -60.72 -70.49 0.17 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.15 -0.477 . . . . 71.21 110.914 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' B ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.04 -173.53 3.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 72.23 110.863 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.43 -74.75 0.65 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.191 -0.459 . . . . 75.5 110.903 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 57.85 -97.92 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.697 -0.763 . . . . 64.2 112.484 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 177.49 164.06 30.4 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.758 -0.734 . . . . 54.23 112.491 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 140.92 43.89 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.692 2.262 . . . . 70.3 112.365 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -129.71 -146.44 6.04 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.739 -0.743 . . . . 61.43 112.477 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -137.04 124.75 22.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.828 0.347 . . . . 73.4 110.889 -179.932 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 14.5 p -134.26 132.25 21.0 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.636 0.731 . . . . 71.33 111.109 179.868 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . 0.419 ' HG2' ' HB2' ' A' ' 54' ' ' TYR . 53.6 Cg_endo -69.8 158.36 57.19 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.677 2.251 . . . . 72.35 112.328 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 2.7 t -76.3 -20.86 15.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 75.43 111.128 179.951 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.4 m -79.71 0.95 28.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 73.44 110.856 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . 0.419 ' HB2' ' HG2' ' A' ' 51' ' ' PRO . 7.5 m-85 -118.75 -27.13 5.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.145 -0.48 . . . . 75.41 110.959 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 13.1 m -106.23 147.9 11.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.081 -0.508 . . . . 70.1 111.123 179.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 15.4 ttp180 -117.66 110.9 18.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 73.21 110.874 -179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 1.6 mp -68.76 112.39 3.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 64.41 111.125 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 7.1 pt -125.22 167.16 19.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.455 . . . . 74.25 111.171 179.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -102.42 125.39 49.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 64.53 110.895 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.3 mt -56.22 -24.7 43.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 72.54 110.951 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.75 -29.92 18.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.15 -0.477 . . . . 73.14 110.856 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -145.92 74.74 13.27 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.596 0.712 . . . . 63.44 110.898 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 -8.83 24.61 Favored 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.711 2.274 . . . . 73.41 112.359 -179.953 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.96 -5.9 36.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 73.33 111.078 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.2 ttmm -84.1 -51.97 6.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 73.34 110.884 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -90.67 -0.08 57.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.444 . . . . 75.52 110.895 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -61.3 -17.86 55.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 62.03 111.12 179.84 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 86.2 p -76.62 -24.16 53.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.25 -0.432 . . . . 75.34 110.817 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 14.2 t -77.77 121.76 31.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 74.24 111.11 179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -90.25 11.68 20.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 73.21 110.835 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 2.0 p 45.91 33.7 1.69 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.471 . . . . 75.52 111.163 -179.883 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -104.12 -54.83 2.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 73.05 110.951 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.86 115.44 4.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 75.02 110.812 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.04 -28.99 19.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.457 . . . . 73.03 110.896 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -66.61 -49.04 67.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 74.0 110.909 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -62.95 -57.0 12.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 74.51 110.961 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 1.7 p -54.31 -31.7 22.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 64.34 111.162 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 11.5 mtm -67.91 -54.11 21.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.492 . . . . 63.44 110.844 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 34.8 mttt -57.55 -35.79 70.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 75.5 110.901 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 41.8 mt -67.71 -50.47 60.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 74.21 111.118 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 96.4 mt -65.64 -35.7 75.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 73.21 111.084 179.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -71.21 -52.05 21.24 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 72.3 110.886 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -58.57 -52.69 64.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.185 -0.461 . . . . 73.32 110.923 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -67.95 -15.51 63.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 73.53 110.885 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.8 mmtm 60.94 54.98 3.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.486 . . . . 65.42 110.942 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 21.2 mt -82.25 131.3 56.52 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.622 0.725 . . . . 71.24 111.129 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.72 162.81 40.59 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.654 2.236 . . . . 73.23 112.346 179.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.19 171.48 7.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.196 -0.456 . . . . 75.23 111.13 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 85.8 t -51.94 -53.98 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 62.43 111.148 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 69.2 mt-10 -51.68 -51.99 51.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 74.32 110.853 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 60.4 mm-40 -59.21 -43.88 92.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.446 . . . . 64.43 110.939 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 32.9 t90 -62.61 -38.75 91.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 71.51 110.893 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 5.8 mmpt? -64.95 -52.8 54.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 71.3 110.867 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.23 -41.92 85.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.234 -0.439 . . . . 73.21 110.879 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -63.09 -46.44 87.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.225 -0.443 . . . . 65.45 110.947 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.1 p -64.58 -33.41 75.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.451 . . . . 71.31 111.152 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -69.99 -63.95 0.98 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 74.12 110.877 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.77 -38.99 65.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 75.24 110.9 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -65.66 -52.87 48.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.194 -0.457 . . . . 62.21 110.908 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.46 -25.3 65.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 74.42 110.93 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -86.33 179.29 6.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.194 -0.457 . . . . 75.31 110.903 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.2 m -96.24 179.16 5.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 74.21 110.856 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.6 m -115.37 -170.56 1.79 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.105 -0.498 . . . . 72.0 110.845 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 27.7 mm -69.97 150.61 10.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.137 -0.483 . . . . 74.51 111.099 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -173.82 -176.43 1.22 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 74.44 110.901 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 28.7 mm -96.8 98.18 7.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.457 . . . . 74.25 111.155 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 171.77 121.67 0.61 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.752 -0.737 . . . . 72.52 112.457 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -52.1 134.8 32.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.853 0.358 . . . . 73.22 110.902 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 169.99 44.03 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.693 -0.765 . . . . 75.44 112.493 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 31.7 t-80 -144.89 163.66 33.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.841 0.353 . . . . 72.11 110.887 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -145.9 -159.99 8.45 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.772 -0.728 . . . . 54.54 112.498 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -157.69 145.0 18.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.776 0.322 . . . . 73.12 110.946 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.7 p -72.34 179.83 3.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 74.4 110.833 -179.744 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -74.42 -56.95 4.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 72.3 110.93 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 107.3 92.11 2.24 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.718 -0.753 . . . . 75.14 112.514 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -110.85 61.08 0.61 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.766 0.317 . . . . 74.01 110.921 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 71.41 110.871 179.94 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 N-CA-C 112.498 -0.241 . . . . 74.33 112.498 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 14.4 ttpp -95.09 -65.97 0.94 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.753 0.311 . . . . 74.23 110.91 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -54.64 -74.72 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.454 . . . . 74.43 110.857 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 22.0 mm 56.48 77.88 0.4 Allowed Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.663 0.744 . . . . 71.03 111.16 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.82 86.9 0.57 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.635 2.223 . . . . 73.25 112.365 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 13.2 t -80.4 -1.39 41.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.456 . . . . 75.53 110.862 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.92 163.2 0.43 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.628 0.727 . . . . 74.25 110.85 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 -22.64 31.87 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.686 2.258 . . . . 74.34 112.385 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.63 84.07 0.19 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.577 0.703 . . . . 74.2 111.135 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 163.24 38.97 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.721 2.28 . . . . 74.31 112.368 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -100.14 160.47 27.02 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.601 0.715 . . . . 72.22 110.879 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 163.84 36.77 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.691 2.261 . . . . 72.22 112.339 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -32.18 19.06 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.702 2.268 . . . . 74.12 112.319 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 1.3 m 56.67 27.39 12.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 75.23 110.862 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 13.1 t -108.94 134.08 52.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.111 -0.495 . . . . 72.24 110.872 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 70.22 111.095 179.902 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 4.0 ppp? . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.764 0.316 . . . . 64.43 110.914 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -136.78 160.38 66.62 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.553 0.692 . . . . 60.13 111.124 179.935 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 83.53 0.69 Allowed 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.683 2.255 . . . . 73.03 112.367 -179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -80.85 147.71 30.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 75.14 110.913 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 12.7 m-85 -116.8 163.9 15.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.469 . . . . 65.1 110.93 179.912 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -142.91 164.02 31.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 72.22 111.099 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 10.9 p -130.71 130.89 64.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 63.44 111.143 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.86 139.6 47.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 74.44 111.09 -179.931 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 23.3 mt -114.07 -11.22 12.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 65.33 110.915 179.903 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -137.01 159.63 41.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 74.02 110.892 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -85.74 108.85 18.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 75.53 110.871 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -93.63 139.28 30.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 75.25 110.855 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -112.97 97.1 6.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.118 -0.492 . . . . 74.41 110.927 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.67 157.36 1.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.451 . . . . 72.12 111.108 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -115.82 -32.97 5.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 73.23 110.894 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -133.11 -178.45 4.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 74.01 110.886 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -63.47 -41.34 98.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.207 -0.451 . . . . 71.11 110.832 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -57.32 -23.68 50.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.211 -0.45 . . . . 63.03 110.901 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.0 152.23 19.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 72.33 110.908 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.2 tt -131.77 120.55 22.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.138 -0.483 . . . . 73.15 110.945 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -63.73 143.62 57.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.235 -0.439 . . . . 74.54 110.836 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -139.95 159.11 26.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 74.13 111.144 -179.984 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.3 m -121.44 158.07 54.57 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.671 0.748 . . . . 73.32 110.861 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.72 117.96 5.39 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.709 2.273 . . . . 75.52 112.375 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.06 4.66 31.14 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.737 -0.744 . . . . 55.04 112.448 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -92.12 154.59 18.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.85 0.357 . . . . 74.52 110.869 -179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -105.61 115.82 30.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 72.5 110.92 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 3.7 mp -116.55 155.35 28.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.201 -0.454 . . . . 71.45 110.938 179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.5 t -108.26 112.79 25.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 73.04 110.895 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 57.4 mt -75.72 144.86 11.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 64.0 111.146 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.8 m -116.23 -43.94 2.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.144 -0.48 . . . . 72.41 110.924 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -161.02 174.8 13.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 71.11 111.115 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.3 p80 -121.18 177.95 4.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 75.52 110.829 -179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.407 ' HB3' ' HB2' ' A' ' 36' ' ' TRP . 20.2 t80 -146.87 100.83 3.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.206 -0.452 . . . . 71.42 110.91 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.415 ' HB3' ' CG ' ' A' ' 35' ' ' GLU . 33.6 t0 59.97 17.5 6.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.098 -0.501 . . . . 64.22 110.905 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 41.3 m-85 63.47 29.65 15.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.169 -0.469 . . . . 72.3 110.939 -179.809 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.415 ' CG ' ' HB3' ' A' ' 33' ' ' ASP . 4.4 pt-20 -131.16 -1.76 4.02 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.101 -0.499 . . . . 64.54 110.921 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.422 ' CZ2' ' HB2' ' B' ' -3' ' ' ARG . 88.1 m95 -152.73 135.52 15.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.107 -0.497 . . . . 74.14 110.905 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -121.78 131.38 54.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.259 -0.428 . . . . 75.12 110.871 -179.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.4 mm -87.04 94.55 4.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 74.4 111.154 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -111.1 138.99 46.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 74.43 111.106 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 51.2 pttt -112.82 153.67 45.07 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.55 0.69 . . . . 74.52 110.903 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 119.56 6.49 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.664 2.243 . . . . 65.3 112.394 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.4 mt -78.07 -19.54 13.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 75.54 111.16 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' A ASN . . . . . . . . . . . . . 7.0 t30 -68.26 -55.83 10.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 65.22 110.936 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' B ARG . . . . . . . . . . . . . 8.0 ptm180 -83.6 -171.3 3.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 75.31 110.832 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 12.0 mt -51.68 -75.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 73.11 110.928 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 177.53 91.3 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.768 -0.729 . . . . 41.23 112.492 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -111.62 80.55 0.27 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.71 -0.757 . . . . 64.52 112.485 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.74 105.22 1.44 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.697 2.265 . . . . 73.44 112.348 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -105.6 -106.47 3.12 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.752 -0.737 . . . . 72.51 112.455 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.3 tt -163.55 124.73 2.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.837 0.351 . . . . 72.25 110.935 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.3 p -137.56 133.8 18.15 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.658 0.742 . . . . 74.11 111.074 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 153.85 68.36 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.661 2.241 . . . . 75.02 112.355 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.9 t -72.59 -21.01 19.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 73.12 111.148 179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.0 m -77.0 -2.58 34.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 71.11 110.837 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 37.7 m-85 -127.22 22.8 6.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.107 -0.497 . . . . 74.13 110.881 -179.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 10.7 m -148.63 163.23 5.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.119 -0.491 . . . . 74.0 111.155 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 26.1 ttm180 -130.57 119.09 21.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.461 . . . . 73.43 110.883 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 43.2 mm -70.13 108.8 2.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.456 . . . . 75.42 111.152 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.4 pt -134.18 132.82 55.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 73.32 111.15 179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -67.34 145.77 54.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 63.32 110.868 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -71.31 -36.67 71.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 73.52 110.911 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.24 -24.49 32.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 74.31 110.898 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -148.76 74.17 10.34 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.607 0.717 . . . . 62.11 110.904 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 -8.57 23.95 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.688 2.259 . . . . 72.22 112.331 -179.956 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.46 -18.46 23.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 72.55 111.113 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.8 ttmt -74.62 -50.32 18.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 73.12 110.921 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 65.5 m-85 -95.25 23.27 5.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 75.31 110.939 -179.972 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -89.48 11.71 18.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.13 -0.486 . . . . 64.04 111.11 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.7 p -114.87 -24.04 8.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 72.52 110.869 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 7.9 p -55.18 140.24 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.145 -0.48 . . . . 71.32 111.134 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -99.44 93.72 6.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 72.43 110.887 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -50.84 -30.15 13.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 70.41 111.127 -179.884 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -57.38 -51.02 71.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 75.52 110.876 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -63.99 110.11 2.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.172 -0.467 . . . . 70.32 110.824 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -24.29 39.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 74.45 110.865 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -66.87 -52.96 37.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 74.32 110.858 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 -60.15 -58.45 8.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 75.01 110.943 -179.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 2.6 p -51.63 -32.27 13.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 74.35 111.162 179.949 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.8 mtm -68.16 -51.73 42.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 70.04 110.93 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.1 mttm -55.39 -47.07 76.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.209 -0.451 . . . . 74.32 110.94 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.7 mp -60.98 -53.73 45.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 75.2 111.153 179.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 82.0 mt -57.35 -36.05 51.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.154 -0.476 . . . . 71.54 111.138 179.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -71.16 -51.9 22.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 75.51 110.883 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -59.14 -49.4 78.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.445 . . . . 74.45 110.924 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -67.9 -15.88 63.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 75.55 110.868 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 29.6 mmtm 61.31 49.51 5.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 75.43 110.873 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 38.2 mt -79.14 125.16 84.04 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.598 0.714 . . . . 73.13 111.158 179.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.68 168.72 20.63 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.699 2.266 . . . . 72.42 112.342 179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.77 167.04 14.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 71.44 111.125 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.2 t -51.04 -58.88 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.205 -0.452 . . . . 74.51 111.139 179.906 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -51.28 -48.04 62.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.481 . . . . 73.05 110.877 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -56.8 -33.48 66.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.465 . . . . 75.42 110.886 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 22.3 t90 -66.78 -41.01 88.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.241 -0.436 . . . . 75.01 110.888 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 16.7 mtmt -67.4 -49.32 64.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 74.15 110.915 179.939 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -61.6 -39.7 92.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 55.14 110.836 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -65.27 -48.84 71.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 72.51 110.937 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 3.6 p -63.19 -33.78 76.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 75.01 111.141 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 10.2 mtm180 -68.18 -58.28 4.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.216 -0.447 . . . . 75.14 110.886 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.17 -25.15 68.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 73.01 110.903 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -83.29 -30.15 27.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 74.44 110.945 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 16.1 mtpt -83.63 -17.14 42.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.112 -0.494 . . . . 74.41 110.946 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -51.34 165.98 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 73.11 110.856 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.5 p -76.9 92.07 3.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.115 -0.493 . . . . 60.44 110.877 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 39.1 m -149.15 -171.81 3.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 62.41 110.883 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 30.0 mm -64.49 138.22 23.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.167 -0.47 . . . . 75.5 111.132 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -178.14 171.85 1.65 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.137 -0.483 . . . . 74.52 110.927 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -142.41 174.33 5.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 65.42 111.117 179.989 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 107.16 84.25 1.67 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.726 -0.75 . . . . 74.43 112.47 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -73.24 123.7 24.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.917 0.389 . . . . 75.43 110.905 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 165.96 98.03 0.12 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.766 -0.731 . . . . 74.03 112.497 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -125.73 162.52 24.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.848 0.356 . . . . 74.34 110.866 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -167.14 179.0 41.08 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.729 -0.748 . . . . 72.14 112.541 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -151.59 166.01 32.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.85 0.357 . . . . 73.45 110.88 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.1 p -155.05 144.23 21.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 64.33 110.855 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.63 138.63 55.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 73.12 110.9 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -129.58 91.37 0.31 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.694 -0.765 . . . . 72.51 112.453 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -127.86 -39.16 1.8 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.795 0.331 . . . . 74.43 110.915 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.201 -0.454 . . . . 74.34 110.887 179.925 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.496 -0.241 . . . . 72.24 112.496 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 32.6 mtpt -95.06 -38.78 10.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.8 0.334 . . . . 64.42 110.941 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -88.93 -76.36 0.41 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 73.35 110.898 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 28.8 mm 50.1 78.18 0.42 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.612 0.72 . . . . 74.22 111.149 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 88.75 0.53 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.689 2.259 . . . . 73.42 112.356 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 36.8 p -78.6 -2.8 40.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 62.34 110.839 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' -3' ' ' ARG . . . . . 0.422 ' HB2' ' CZ2' ' A' ' 36' ' ' TRP . 22.3 mmm-85 -49.92 160.53 0.63 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.616 0.722 . . . . 75.54 110.853 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 -19.27 36.61 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.673 2.249 . . . . 74.23 112.337 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.54 84.29 0.18 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.596 0.712 . . . . 72.01 111.135 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.66 160.06 51.14 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.717 2.278 . . . . 73.51 112.365 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.75 160.47 27.8 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.543 0.687 . . . . 63.24 110.884 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 167.28 24.91 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.658 2.238 . . . . 72.42 112.338 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.81 -177.62 1.98 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.705 2.27 . . . . 62.31 112.313 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 27.0 t -171.68 133.62 0.78 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 72.02 110.842 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 11.7 m -125.36 135.09 52.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 74.14 110.863 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 63.55 111.056 179.946 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.781 0.324 . . . . 70.55 110.898 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -51.99 160.82 1.07 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.599 0.714 . . . . 73.32 111.108 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 128.8 16.55 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.677 2.251 . . . . 73.13 112.33 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -112.25 125.01 53.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.153 -0.476 . . . . 72.43 110.899 179.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -140.89 139.8 34.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 75.22 110.889 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -128.22 159.61 34.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.113 -0.494 . . . . 72.44 111.094 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.1 p -127.75 120.9 55.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.259 -0.428 . . . . 73.32 111.166 179.965 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -62.98 128.48 36.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 71.2 111.143 -179.934 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 33.9 mt -101.57 -15.54 17.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.225 -0.443 . . . . 64.52 110.927 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -137.51 157.68 46.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 75.54 110.948 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -80.08 105.09 11.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.099 -0.5 . . . . 72.4 110.925 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -93.55 101.08 13.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 64.33 110.887 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.34 121.54 25.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.474 . . . . 75.5 110.915 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.59 146.84 52.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 71.32 111.095 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -116.34 -26.63 7.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.238 -0.437 . . . . 75.22 110.853 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -124.36 178.53 5.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 75.23 110.862 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -68.8 -26.71 65.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.192 -0.458 . . . . 74.35 110.849 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -77.36 -31.56 54.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 73.44 110.898 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -74.36 148.49 41.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 72.42 110.907 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.7 tp -122.31 134.79 54.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.191 -0.459 . . . . 70.22 110.906 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -80.41 132.44 35.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.444 . . . . 75.34 110.852 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.7 p -146.38 147.05 18.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 71.53 111.115 179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.3 m -107.83 160.27 27.42 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.667 0.746 . . . . 73.2 110.849 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 125.91 12.68 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.7 2.266 . . . . 74.34 112.315 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.05 1.5 31.7 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.777 -0.725 . . . . 50.11 112.523 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 6.5 mm-40 -92.23 163.85 13.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.854 0.359 . . . . 64.42 110.927 -179.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -113.19 122.02 46.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 75.51 110.879 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -117.1 151.69 36.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 75.22 110.925 179.957 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.78 112.58 24.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.469 . . . . 74.24 110.886 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 68.9 mt -77.88 143.35 12.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.107 -0.497 . . . . 71.44 111.124 179.971 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -118.94 -41.74 2.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.159 -0.473 . . . . 74.35 110.883 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -158.95 174.17 15.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.231 -0.441 . . . . 72.22 111.111 179.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -127.71 178.84 5.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.449 . . . . 73.24 110.869 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -138.34 100.25 4.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 75.32 110.895 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 45.9 t0 54.98 25.49 6.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 71.1 110.856 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.7 m-85 63.86 16.03 9.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.244 -0.435 . . . . 73.45 110.927 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -103.46 -50.04 3.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 75.35 110.866 -179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 81.6 m95 -112.42 164.64 13.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.12 -0.491 . . . . 73.44 110.923 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -138.23 155.94 48.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 73.54 110.884 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 11.5 mm -113.94 94.29 3.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.133 -0.485 . . . . 73.53 111.079 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -108.28 146.69 32.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 54.13 111.078 179.811 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.3 mttm -115.79 153.91 48.09 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.571 0.701 . . . . 72.42 110.886 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 118.67 5.82 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.664 2.242 . . . . 75.13 112.311 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 30.6 mt -89.21 -22.49 6.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.189 -0.46 . . . . 71.11 111.149 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' A ASN . . . . . . . . . . . . . 28.7 t-20 -73.32 -66.36 0.7 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 73.45 110.833 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' B ARG . . . . . . . . . . . . . 9.5 ptp85 -74.34 -172.98 1.57 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 75.21 110.905 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.9 mt -55.21 -74.61 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 72.31 110.934 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -167.97 164.33 37.88 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.73 -0.748 . . . . 65.52 112.454 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 167.61 76.07 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.751 -0.738 . . . . 75.25 112.467 -179.892 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 113.05 3.25 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.69 2.26 . . . . 73.42 112.329 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -117.86 -131.27 4.44 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.752 -0.737 . . . . 72.23 112.488 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -146.04 128.35 15.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.845 0.355 . . . . 74.23 110.91 -179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.7 p -142.98 131.06 11.23 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.616 0.722 . . . . 73.24 111.146 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 163.0 39.96 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.698 2.266 . . . . 75.1 112.283 179.994 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 9.6 t -69.88 -21.64 24.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.221 -0.445 . . . . 74.24 111.155 179.914 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.2 m -80.48 -0.23 36.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.145 -0.48 . . . . 74.45 110.83 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -124.36 12.88 8.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.132 -0.486 . . . . 74.2 110.945 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 10.3 m -152.84 139.27 12.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 73.22 111.164 179.89 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 19.6 ttm180 -112.08 119.74 39.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 73.05 110.861 -179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 16.5 mm -66.54 109.29 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 75.15 111.162 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.2 pt -131.6 128.19 60.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.466 . . . . 74.32 111.157 179.855 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.72 126.28 27.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 74.22 110.89 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 17.1 tp -58.26 -29.77 66.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 73.4 110.941 -179.945 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 9.0 mmt -88.64 -1.45 58.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 74.42 110.849 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -170.88 82.6 0.53 Allowed Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.602 0.715 . . . . 75.33 110.909 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 -7.12 20.23 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.678 2.252 . . . . 74.52 112.398 -179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -100.69 -2.64 32.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 71.35 111.14 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.3 ttpt -81.58 -52.55 7.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 75.35 110.888 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 32.8 m-85 -104.24 23.51 12.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.271 -0.422 . . . . 74.14 110.934 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -79.88 -18.24 51.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 72.45 111.117 179.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.8 p -106.12 22.85 15.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 71.0 110.875 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 8.0 p -90.86 149.2 4.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.15 -0.477 . . . . 74.01 111.165 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -98.61 83.85 3.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 62.35 110.87 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -51.25 -44.57 61.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 74.11 111.113 -179.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -54.15 -40.63 67.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 73.13 110.943 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 61.4 t0 -63.71 107.34 1.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.491 . . . . 73.13 110.843 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.7 -28.56 22.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 75.25 110.831 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -66.89 -56.26 11.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 74.32 110.874 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -59.25 -56.1 26.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 65.43 110.908 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.5 p -53.14 -32.12 18.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 75.34 111.135 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 12.2 mtm -67.47 -54.55 19.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 75.43 110.887 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.6 mttp -55.63 -39.28 70.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.445 . . . . 72.11 110.906 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 83.3 mt -64.34 -54.9 25.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 71.04 111.156 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 97.1 mt -59.91 -35.36 60.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 75.21 111.166 179.843 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -69.09 -49.38 57.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.175 -0.466 . . . . 60.43 110.894 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -62.23 -43.57 98.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 73.33 110.879 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -75.5 -18.23 59.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 74.35 110.857 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 60.1 mmtt 63.18 49.53 3.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 72.42 110.904 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 21.1 mt -77.33 129.65 77.02 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.618 0.723 . . . . 74.43 111.156 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 163.29 38.8 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.704 2.269 . . . . 74.4 112.356 179.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.85 166.17 12.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.248 -0.433 . . . . 72.1 111.108 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 91.4 t -50.66 -54.58 9.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 65.34 111.128 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -51.34 -49.11 62.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.173 -0.467 . . . . 73.44 110.917 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -56.98 -46.47 82.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 72.12 110.919 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -59.14 -37.79 78.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.228 -0.442 . . . . 74.21 110.91 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.09 -43.53 82.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.231 -0.44 . . . . 75.41 110.892 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -65.5 -36.07 82.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.263 -0.426 . . . . 73.53 110.858 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -72.96 -38.0 66.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 73.3 110.913 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 5.9 p -74.85 -44.33 49.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 73.43 111.168 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.6 -34.46 77.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 74.43 110.839 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 10.6 ptt85 -80.22 -32.28 38.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.191 -0.459 . . . . 71.23 110.886 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -80.8 -23.61 39.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 71.12 110.924 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.7 mmmm -88.41 -17.08 31.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.133 -0.485 . . . . 73.42 110.906 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -51.09 167.73 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 73.32 110.918 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.2 p -90.69 78.19 6.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.158 -0.474 . . . . 73.53 110.819 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 75.0 m -100.92 -174.83 2.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.117 -0.492 . . . . 75.32 110.846 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 7.6 mm -98.88 160.73 3.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 62.54 111.126 179.907 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.8 mt-30 -69.48 -168.79 0.18 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.124 -0.489 . . . . 74.43 110.915 179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.2 mp -131.2 134.42 61.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.155 -0.475 . . . . 74.24 111.12 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -81.31 64.3 4.19 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.759 -0.734 . . . . 72.01 112.486 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 23.6 p-10 -106.27 141.75 37.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.85 0.357 . . . . 72.11 110.891 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -107.78 178.94 21.77 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.74 -0.743 . . . . 51.23 112.469 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 41.6 m80 -109.25 162.1 14.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.894 0.378 . . . . 73.1 110.807 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -77.09 -162.98 17.06 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.719 -0.753 . . . . 61.54 112.465 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -153.18 154.6 35.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.801 0.334 . . . . 75.32 110.902 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.4 m -136.53 126.96 26.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 75.3 110.864 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -165.53 140.65 4.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.117 -0.492 . . . . 74.54 110.877 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -135.5 99.9 0.33 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.773 -0.727 . . . . 72.33 112.507 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 49.6 mt -80.81 -61.12 2.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.814 0.34 . . . . 75.33 110.924 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 73.54 110.885 179.939 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 N-CA-C 112.525 -0.23 . . . . 61.43 112.525 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.16 -33.03 4.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.884 0.373 . . . . 75.32 110.935 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -72.14 -75.13 0.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 71.41 110.845 -179.996 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 31.2 mm 51.18 81.42 0.26 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.649 0.738 . . . . 73.22 111.146 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 81.7 0.81 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.676 2.251 . . . . 65.2 112.323 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 40.6 t -89.06 3.0 53.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.24 -0.436 . . . . 74.01 110.84 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -50.97 162.83 0.55 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.606 0.717 . . . . 73.34 110.836 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 -23.05 31.36 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.684 2.256 . . . . 72.4 112.344 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.01 90.49 0.09 OUTLIER Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.583 0.706 . . . . 74.13 111.07 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 158.41 57.0 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.71 2.273 . . . . 71.14 112.311 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.97 150.38 40.47 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.566 0.698 . . . . 74.35 110.926 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 166.21 28.36 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.622 2.214 . . . . 73.12 112.358 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.82 111.99 2.97 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.656 2.237 . . . . 75.5 112.342 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -55.22 -40.26 70.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 75.22 110.874 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 4.1 p -52.27 -35.02 48.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.124 -0.489 . . . . 64.22 110.826 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 65.31 111.06 179.92 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 3.8 ptt? . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.766 0.317 . . . . 74.34 110.884 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -93.97 160.15 32.95 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.565 0.698 . . . . 74.14 111.071 179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 120.09 6.93 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.687 2.258 . . . . 73.54 112.364 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -118.93 156.17 30.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.24 -0.437 . . . . 74.11 110.932 179.973 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 68.0 m-85 -139.49 163.42 32.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 75.1 110.887 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -134.44 167.15 21.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.149 -0.478 . . . . 71.03 111.098 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.3 p -128.51 128.86 68.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 74.32 111.157 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -72.16 138.42 47.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 63.43 111.132 -179.961 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 18.0 mt -114.47 -15.39 12.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.229 -0.441 . . . . 73.01 110.956 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -137.42 158.35 44.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.139 -0.482 . . . . 74.11 110.927 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -83.04 104.83 13.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.1 -0.5 . . . . 73.51 110.874 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -88.96 103.81 16.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.192 -0.458 . . . . 73.13 110.892 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.1 mttm -79.4 112.05 16.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 72.41 110.918 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -71.85 163.11 28.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.237 -0.438 . . . . 72.02 111.122 179.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -119.01 -31.46 4.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.456 . . . . 73.44 110.909 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.1 mmm-85 -139.38 -174.76 3.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 75.34 110.814 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -64.54 -39.93 94.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 73.35 110.823 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.41 -28.0 40.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.194 -0.457 . . . . 73.32 110.87 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -88.98 -178.16 5.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 74.42 110.909 -179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.6 tp -150.41 123.18 8.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.122 -0.49 . . . . 74.32 110.912 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -80.53 124.52 29.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.214 -0.448 . . . . 72.35 110.913 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.4 p -139.53 155.06 25.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.441 . . . . 70.41 111.123 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.0 m -111.11 159.34 33.08 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.65 0.738 . . . . 75.22 110.829 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 123.01 9.67 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.642 2.228 . . . . 72.41 112.32 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.41 -3.32 32.81 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.775 -0.726 . . . . 72.34 112.488 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -89.98 145.7 24.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.891 0.377 . . . . 75.31 110.874 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -86.67 142.06 28.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 75.31 110.842 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 5.3 mp -144.46 151.91 39.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.466 . . . . 74.14 110.922 179.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.5 t -107.08 125.56 51.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 74.24 110.876 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 53.5 mt -86.06 143.97 10.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 72.25 111.146 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 23.5 m -112.55 -37.72 4.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.18 -0.464 . . . . 74.05 110.922 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -164.27 176.16 9.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 74.51 111.129 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.6 p80 -126.61 178.26 6.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 74.41 110.876 179.996 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -141.03 99.65 3.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.211 -0.45 . . . . 75.2 110.903 -179.801 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 54.92 24.01 5.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.129 -0.487 . . . . 62.01 110.858 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 63.6 15.3 8.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.201 -0.454 . . . . 75.03 110.92 -179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 22.0 mm-40 -103.32 -49.17 3.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.498 . . . . 74.43 110.896 -179.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -114.52 146.16 41.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 75.43 110.918 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -119.18 149.11 42.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.435 . . . . 75.34 110.897 -179.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.2 mm -108.53 96.27 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 74.25 111.103 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -105.71 161.62 14.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 73.2 111.133 179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -136.59 158.32 73.45 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.534 0.683 . . . . 73.54 110.879 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.79 131.87 22.1 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.689 2.26 . . . . 71.44 112.372 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 27.0 mm -81.59 -45.55 20.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.446 . . . . 75.13 111.104 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' A ASN . . . . . . . . . . . . . 2.7 m120 -109.64 -44.26 3.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 74.12 110.928 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' B ARG . . . . . . . . . . . . . 4.2 mmt180 -51.8 169.87 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 72.44 110.844 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.3 mp -54.75 120.35 6.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 74.14 110.923 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -47.2 120.22 5.29 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.753 -0.736 . . . . 65.5 112.517 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 178.16 81.84 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.767 -0.73 . . . . 71.12 112.474 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 141.03 44.09 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.701 2.267 . . . . 74.41 112.337 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -126.19 -105.34 1.44 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.719 -0.753 . . . . 62.21 112.447 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -162.63 125.69 2.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.85 0.357 . . . . 73.14 110.896 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 10.0 p -136.51 132.99 18.95 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.583 0.706 . . . . 74.42 111.107 179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 144.87 55.53 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.686 2.257 . . . . 61.41 112.347 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 18.4 t -58.24 -22.15 19.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 72.24 111.16 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.1 m -77.61 -2.55 36.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.476 . . . . 71.52 110.814 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.8 m-85 -125.82 22.93 7.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.485 . . . . 73.35 110.91 -179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 1.7 m -156.27 154.75 6.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.121 -0.491 . . . . 74.02 111.121 179.919 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 37.6 ttm-85 -121.41 128.44 52.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 74.54 110.873 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.5 mm -76.72 110.02 11.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.183 -0.462 . . . . 62.22 111.136 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 7.0 pt -126.13 -177.78 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.479 . . . . 62.33 111.082 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -126.09 124.48 40.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.162 -0.472 . . . . 55.54 110.895 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -55.02 -26.39 36.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 74.43 110.913 -179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.6 mpp? -90.17 -25.57 20.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 73.03 110.917 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -147.83 75.0 11.11 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.601 0.715 . . . . 63.41 110.872 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 -8.39 23.49 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.676 2.251 . . . . 73.43 112.331 -179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -100.14 -12.92 19.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 72.23 111.132 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.5 ttmm -80.02 -52.1 8.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 74.21 110.908 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 78.9 m-85 -95.45 23.11 6.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.446 . . . . 75.43 110.931 -179.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -90.06 9.91 26.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 75.42 111.101 179.909 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 64.4 p -116.62 -24.13 7.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.221 -0.445 . . . . 74.45 110.796 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 13.9 p -56.65 135.28 20.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.17 -0.468 . . . . 71.34 111.12 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -90.33 100.67 13.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 74.14 110.848 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.78 -30.47 65.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 73.02 111.115 -179.851 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -62.72 -44.64 95.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.228 -0.442 . . . . 73.32 110.916 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.6 t0 -63.72 106.56 1.0 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.491 . . . . 72.52 110.869 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.44 -27.94 27.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 75.35 110.851 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -66.52 -54.46 23.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 75.42 110.884 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -59.75 -57.62 12.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.146 -0.479 . . . . 73.45 110.912 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 4.3 p -51.89 -32.76 15.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 75.43 111.12 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 16.5 mtm -67.87 -50.82 54.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 74.41 110.902 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.4 mttt -56.28 -43.86 79.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.254 -0.43 . . . . 75.15 110.854 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.6 mp -63.97 -54.82 26.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 74.11 111.131 179.884 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 87.2 mt -57.68 -37.02 56.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.222 -0.445 . . . . 72.53 111.129 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -71.07 -51.71 23.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.21 -0.45 . . . . 64.33 110.834 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -59.47 -50.26 74.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 75.05 110.898 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -67.88 -13.42 62.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 75.11 110.906 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 63.1 mmtt 61.11 48.36 6.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.097 -0.501 . . . . 73.43 110.906 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 24.6 mt -81.66 122.43 80.48 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.651 0.739 . . . . 74.13 111.118 179.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.8 159.49 53.2 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.703 2.269 . . . . 72.53 112.32 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -81.38 174.81 11.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.216 -0.447 . . . . 73.42 111.1 -179.931 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 24.1 t -53.81 -58.53 3.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.459 . . . . 73.54 111.136 179.898 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -50.75 -47.68 59.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 72.33 110.874 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -56.12 -39.24 71.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.458 . . . . 74.45 110.912 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -62.03 -48.43 80.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 73.44 110.89 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 17.7 mtmt -58.09 -50.79 72.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.217 -0.447 . . . . 73.23 110.897 179.931 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -58.35 -51.68 68.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.258 -0.428 . . . . 71.24 110.865 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -50.63 -52.56 38.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 75.4 110.897 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.86 -39.05 76.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 75.22 111.118 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -59.33 -45.51 91.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.248 -0.433 . . . . 74.23 110.883 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 -65.13 -45.22 85.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 64.41 110.84 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 24.3 t80 -67.53 -25.13 65.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.459 . . . . 72.4 110.925 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.8 mtpm? -88.07 -25.81 22.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.118 -0.492 . . . . 75.41 110.907 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -93.4 -176.16 4.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.208 -0.451 . . . . 73.02 110.884 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 7.7 t -52.08 158.35 1.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.476 . . . . 65.33 110.86 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.68 176.7 7.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 73.42 110.812 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 4.9 mm -105.82 162.36 5.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.125 -0.489 . . . . 75.21 111.154 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -52.14 171.39 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 74.52 110.941 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.7 mp -117.92 98.31 6.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 75.21 111.114 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -134.23 107.78 0.68 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.693 -0.765 . . . . 75.45 112.486 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -76.88 133.05 39.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.856 0.36 . . . . 74.34 110.906 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -117.59 100.78 0.89 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.739 -0.743 . . . . 53.41 112.481 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -145.58 156.41 43.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.839 0.352 . . . . 74.15 110.865 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 159.56 114.56 0.38 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.788 -0.72 . . . . 64.45 112.497 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -175.64 149.2 0.95 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.786 0.327 . . . . 75.34 110.915 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 65.9 m -141.85 172.64 12.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 74.44 110.896 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -151.61 166.52 30.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 73.41 110.931 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -140.56 137.74 8.5 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.723 -0.751 . . . . 64.45 112.468 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 73.7 mt -110.01 -179.73 3.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.755 0.312 . . . . 75.43 110.923 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 60.32 110.897 179.964 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 N-CA-C 112.458 -0.257 . . . . 74.21 112.458 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 4.6 tttp -137.25 -51.76 0.66 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.815 0.341 . . . . 72.21 110.866 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 -94.11 -78.21 0.44 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 73.24 110.866 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 3.5 mp 47.95 84.73 0.19 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.618 0.723 . . . . 74.41 111.103 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 85.53 0.61 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.688 2.259 . . . . 74.41 112.361 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 1.3 t -74.28 -8.47 56.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.216 -0.447 . . . . 61.34 110.888 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.08 160.39 6.37 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.609 0.719 . . . . 71.21 110.872 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 154.65 67.72 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.688 2.258 . . . . 74.33 112.333 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -107.92 87.42 3.73 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.565 0.698 . . . . 75.45 111.108 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 149.0 66.57 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.721 2.281 . . . . 74.32 112.374 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.0 159.91 64.5 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.58 0.705 . . . . 74.44 110.86 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 167.11 25.46 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.626 2.217 . . . . 55.35 112.351 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -36.45 10.69 Favored 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.69 2.26 . . . . 74.54 112.335 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 19.4 t -106.99 121.29 44.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.265 -0.425 . . . . 74.14 110.839 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 50.6 m -122.15 97.8 5.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.484 . . . . 71.14 110.841 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 74.24 111.065 179.927 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 20.7 ptm . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.762 0.315 . . . . 73.15 110.922 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -130.66 160.3 66.93 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.582 0.706 . . . . 75.51 111.089 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.82 86.73 0.58 Allowed 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.708 2.272 . . . . 71.32 112.302 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -95.31 149.86 20.88 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.209 -0.451 . . . . 72.53 110.96 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 14.0 m-85 -128.23 163.14 25.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.209 -0.45 . . . . 73.52 110.913 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -134.6 170.05 16.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 73.52 111.122 179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.4 p -133.14 131.27 58.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 74.32 111.092 179.993 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.05 134.53 41.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 71.04 111.171 179.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.6 mt -109.22 -13.05 14.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 72.55 110.919 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -137.31 156.23 48.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 70.14 110.896 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -83.55 104.98 14.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.11 -0.495 . . . . 54.45 110.886 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -108.72 102.43 11.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.178 -0.465 . . . . 74.21 110.848 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp -78.96 124.34 28.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.114 -0.494 . . . . 75.31 110.928 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.41 145.4 56.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 72.24 111.105 179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -96.65 -31.62 12.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 74.22 110.899 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -140.21 179.17 6.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.136 -0.484 . . . . 75.24 110.907 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -59.87 -29.78 68.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.216 -0.447 . . . . 75.04 110.906 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -65.15 -24.56 67.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 74.21 110.868 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -104.79 147.92 27.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.459 . . . . 71.43 110.896 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 tp -118.12 119.18 33.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.165 -0.47 . . . . 74.41 110.965 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -57.31 141.34 47.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 63.54 110.865 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -145.4 158.69 13.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 74.24 111.124 -179.987 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.5 m -129.09 160.32 64.33 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.656 0.741 . . . . 73.11 110.877 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 119.46 6.41 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.687 2.258 . . . . 72.24 112.374 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.49 -0.46 30.86 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.741 -0.742 . . . . 65.4 112.468 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.7 mp0 -88.24 166.0 14.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.82 0.343 . . . . 70.21 110.888 -179.881 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.4 m120 -117.38 127.03 53.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 64.43 110.917 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.2 mp -127.41 158.99 35.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 74.34 110.917 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.0 t -111.13 114.87 28.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 74.2 110.878 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 57.2 mt -79.69 144.61 10.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 75.13 111.143 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 29.3 m -118.36 -41.65 2.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 74.34 110.899 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -155.67 174.63 15.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 74.42 111.093 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.3 p80 -126.89 177.73 6.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 70.21 110.868 179.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.2 t80 -139.91 99.56 3.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 75.32 110.941 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 55.11 25.16 6.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 64.02 110.843 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 34.2 m-85 63.48 16.3 9.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.225 -0.443 . . . . 74.11 110.935 -179.806 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -103.62 -50.32 3.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 73.51 110.935 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.405 ' CZ2' ' HB2' ' B' ' -3' ' ' ARG . 78.5 m95 -113.06 153.78 27.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.09 -0.505 . . . . 75.54 110.923 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -126.38 142.64 51.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.25 -0.432 . . . . 71.32 110.933 -179.998 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 21.7 mm -99.16 95.64 4.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.154 -0.475 . . . . 74.44 111.109 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -108.1 152.86 23.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.461 . . . . 73.14 111.13 179.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.2 mtpt -125.1 159.49 59.03 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.589 0.709 . . . . 74.43 110.905 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.7 139.74 41.17 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.67 2.247 . . . . 74.55 112.381 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 44.2 mt -101.33 -23.65 4.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.447 . . . . 75.31 111.177 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' A ASN . . . . . . . . . . . . . 20.6 t-20 -92.83 -32.35 14.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 73.3 110.879 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' B ARG . . . . . . . . . . . . . 15.5 mmp_? -73.2 -168.98 0.56 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 75.32 110.893 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.16 12.08 36.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 74.22 110.964 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 119.85 124.24 3.19 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.742 -0.742 . . . . 73.01 112.487 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -171.01 76.67 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.752 -0.737 . . . . 63.31 112.458 -179.926 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 116.97 4.81 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.654 2.236 . . . . 64.54 112.357 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -116.91 -111.8 2.65 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.751 -0.738 . . . . 72.22 112.518 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -172.12 124.61 0.52 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.843 0.354 . . . . 73.13 110.949 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.1 p -139.46 132.98 15.65 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.58 0.705 . . . . 64.3 111.146 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.75 160.58 49.19 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.66 2.24 . . . . 73.23 112.325 179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 8.4 t -72.11 -20.97 20.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 75.3 111.114 179.911 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.0 m -79.15 -0.17 30.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 72.44 110.832 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -127.49 17.36 7.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 73.5 110.947 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.8 m -151.87 161.15 3.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.086 -0.507 . . . . 71.03 111.115 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 39.0 ttm-85 -128.99 131.75 47.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.166 -0.47 . . . . 74.35 110.845 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 31.1 mm -80.59 108.85 14.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 75.43 111.124 179.957 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 4.6 pt -126.81 140.19 49.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 75.41 111.078 179.868 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -76.36 128.57 35.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.136 -0.483 . . . . 71.05 110.872 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -60.42 -34.97 74.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.181 -0.463 . . . . 73.34 110.872 -179.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.1 mmt -83.78 -1.6 54.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 74.13 110.894 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -178.91 82.93 0.21 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.665 0.745 . . . . 62.02 110.884 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.81 -7.93 22.31 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.704 2.27 . . . . 71.31 112.284 -179.919 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.46 -8.49 44.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 73.12 111.146 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -81.97 -47.09 13.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 74.14 110.883 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 14.2 m-85 -103.72 23.47 12.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 74.24 110.916 -179.956 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -84.23 -16.87 41.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 73.45 111.09 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 39.8 p -94.18 -23.76 17.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 71.34 110.829 -179.734 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 9.8 p -51.33 155.95 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.083 -0.508 . . . . 74.43 111.168 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -113.31 106.77 15.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 75.42 110.857 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -70.5 -20.81 62.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.445 . . . . 75.03 111.14 -179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -62.77 -54.91 31.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.231 -0.441 . . . . 74.11 110.91 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -63.89 116.73 6.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 73.54 110.893 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.48 -22.14 41.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 75.21 110.896 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -66.84 -56.01 12.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.175 -0.466 . . . . 74.34 110.928 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -58.71 -57.12 14.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 72.52 110.924 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.2 p -52.72 -31.91 16.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 73.2 111.13 179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.8 mtm -67.57 -55.12 14.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 73.03 110.865 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 50.8 mttt -55.36 -38.64 69.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 75.24 110.944 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 15.4 mt -65.3 -53.08 44.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.226 -0.443 . . . . 73.53 111.105 179.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 96.1 mt -61.95 -35.9 70.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 74.42 111.145 179.813 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -71.02 -44.77 65.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 72.43 110.905 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -67.89 -47.84 67.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 71.2 110.891 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -69.21 -11.5 60.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 74.5 110.86 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 45.9 mmtt 58.32 53.89 6.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.461 . . . . 72.45 110.887 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 23.7 mt -88.14 124.33 66.88 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 75.24 111.134 179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 164.15 35.63 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.642 2.228 . . . . 71.14 112.33 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.97 167.33 13.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 75.42 111.128 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . 0.478 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 97.7 t -50.61 -58.41 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 75.11 111.122 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -46.05 -53.16 10.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 72.13 110.906 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 74.9 mm-40 -56.38 -34.16 66.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 63.01 110.913 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . 0.408 ' HA ' ' HG2' ' A' ' 95' ' ' GLN . 26.8 t90 -71.25 -36.2 71.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.199 -0.455 . . . . 75.5 110.878 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.478 ' HG2' ' O ' ' A' ' 89' ' ' VAL . 1.6 mmmt -68.62 -37.56 79.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.451 . . . . 74.34 110.917 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -71.38 -50.83 28.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.227 -0.442 . . . . 74.23 110.888 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . 0.408 ' HG2' ' HA ' ' A' ' 92' ' ' TRP . 5.1 pt20 -58.8 -38.83 79.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.194 -0.457 . . . . 73.13 110.867 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 26.2 p -70.56 -47.47 60.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.251 -0.431 . . . . 72.12 111.093 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -56.19 -45.04 79.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.445 . . . . 74.31 110.867 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 6.0 ptm180 -74.3 -34.87 63.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.243 -0.435 . . . . 72.41 110.857 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -64.22 -35.26 80.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.177 -0.465 . . . . 75.42 110.939 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 38.2 mmtt -77.69 -25.5 49.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.109 -0.496 . . . . 75.45 110.922 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -67.94 176.69 2.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 74.02 110.872 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 30.0 t -58.05 113.87 2.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 70.1 110.856 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 17.1 m -160.26 -173.28 3.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 74.42 110.888 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 12.5 mm -81.07 154.21 4.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 74.42 111.149 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -171.51 -179.03 2.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 73.54 110.926 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.1 mp -127.23 104.32 12.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.229 -0.441 . . . . 63.54 111.122 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 102.03 179.11 27.73 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.751 -0.737 . . . . 63.24 112.487 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -78.06 120.97 23.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.898 0.38 . . . . 72.22 110.913 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -89.61 171.85 38.45 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.764 -0.731 . . . . 75.22 112.502 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 68.6 m80 -119.19 158.82 25.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.91 0.386 . . . . 72.04 110.829 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -167.48 103.9 0.21 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.747 -0.74 . . . . 65.52 112.492 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 16.5 mp0 -122.32 170.29 10.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.842 0.353 . . . . 72.31 110.899 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.2 p -169.44 151.44 4.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 75.02 110.86 -179.769 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -134.75 153.78 51.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.135 -0.484 . . . . 74.33 110.939 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -140.82 113.79 0.89 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.789 -0.72 . . . . 73.15 112.537 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.62 -32.05 7.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.771 0.32 . . . . 74.22 110.908 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 74.24 110.909 179.953 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 N-CA-C 112.495 -0.242 . . . . 74.51 112.495 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 12.1 tptt -71.02 -74.1 0.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.834 0.35 . . . . 72.22 110.852 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -76.11 -71.83 0.36 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 73.45 110.91 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.8 mm 51.41 74.37 0.81 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.651 0.739 . . . . 71.1 111.119 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 101.26 0.9 Allowed 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.703 2.268 . . . . 75.04 112.326 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 24.2 t -89.33 1.47 55.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 71.1 110.841 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' -3' ' ' ARG . . . . . 0.405 ' HB2' ' CZ2' ' A' ' 36' ' ' TRP . 19.7 mmt-85 -50.75 160.38 0.79 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.589 0.709 . . . . 74.44 110.915 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 -22.88 31.62 Favored 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.725 2.283 . . . . 70.24 112.354 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.6 85.03 0.17 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.585 0.707 . . . . 74.33 111.122 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 159.45 53.41 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.742 2.295 . . . . 74.52 112.303 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 11.4 mtpt -94.7 160.08 32.12 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.565 0.698 . . . . 74.13 110.9 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 166.66 26.76 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.668 2.245 . . . . 74.23 112.369 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 -23.64 30.6 Favored 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.7 2.267 . . . . 71.41 112.332 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 2.4 p -52.21 -37.78 55.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.235 -0.438 . . . . 75.21 110.88 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 2.1 m -132.62 138.34 47.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.144 -0.48 . . . . 64.43 110.894 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.11 -0.496 . . . . 62.13 111.135 179.91 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 11.3 tpt . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.823 0.344 . . . . 74.21 110.866 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -143.09 156.94 61.46 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.569 0.7 . . . . 71.13 111.077 179.914 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 83.74 0.68 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.659 2.24 . . . . 72.53 112.383 179.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 pt? -67.08 146.06 54.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.46 . . . . 74.32 110.932 -179.998 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -112.06 145.15 40.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.258 -0.428 . . . . 75.04 110.893 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -126.66 153.57 45.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 73.31 111.118 179.957 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.6 p -121.66 122.5 67.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.24 -0.436 . . . . 74.41 111.129 179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -59.18 140.17 56.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 73.12 111.126 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 3.5 mt -106.04 -16.42 14.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 71.21 110.907 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -139.25 164.31 30.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 74.12 110.911 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -87.19 104.8 16.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 72.01 110.895 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -106.74 109.37 21.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 73.23 110.86 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -83.84 142.24 30.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.105 -0.498 . . . . 75.44 110.947 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.62 136.1 50.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.425 . . . . 72.33 111.093 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -105.53 -26.61 11.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.449 . . . . 74.14 110.884 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -127.1 -178.59 4.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.49 . . . . 73.25 110.886 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -67.43 -25.97 66.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 71.41 110.879 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.74 -45.6 15.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 73.02 110.823 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -55.88 158.27 3.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 70.52 110.939 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tp -133.73 145.81 50.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 65.24 110.918 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -82.65 130.74 35.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 74.13 110.881 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -139.96 158.93 26.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 75.34 111.149 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -125.18 159.09 61.15 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.692 0.758 . . . . 62.23 110.873 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 117.78 5.29 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.698 2.265 . . . . 72.53 112.312 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.25 7.12 35.61 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.756 -0.735 . . . . 63.23 112.495 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -92.2 153.69 19.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.898 0.38 . . . . 62.13 110.872 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.0 m120 -94.8 123.11 38.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.158 -0.474 . . . . 75.44 110.855 -179.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 7.9 mp -124.1 149.32 46.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.208 -0.451 . . . . 71.32 110.907 179.944 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.79 123.89 46.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.457 . . . . 63.41 110.889 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 31.7 mm -74.74 144.84 11.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.132 -0.485 . . . . 74.44 111.087 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 55.8 m -124.6 -35.2 2.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.134 -0.485 . . . . 64.53 110.888 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -176.03 171.9 2.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 61.33 111.088 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 1.7 p80 -124.95 173.35 8.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 75.35 110.86 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -135.39 99.55 4.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.241 -0.436 . . . . 63.22 110.906 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.8 t0 53.88 26.46 6.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.116 -0.493 . . . . 54.44 110.878 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 43.7 m-85 62.77 27.77 16.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 73.22 110.938 -179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -116.69 -48.24 2.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 72.24 110.9 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 70.1 m95 -114.09 145.86 41.04 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.153 -0.476 . . . . 73.24 110.942 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -121.08 139.46 53.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.258 -0.428 . . . . 75.51 110.9 -179.931 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.6 mm -95.02 95.21 4.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.191 -0.459 . . . . 72.04 111.124 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -107.55 145.06 33.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 74.44 111.102 179.807 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -123.53 156.59 64.09 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.567 0.698 . . . . 75.23 110.89 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 125.71 12.45 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.672 2.248 . . . . 72.41 112.367 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 58.4 mt -83.85 -35.54 11.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 71.45 111.131 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' A ASN . . . . . . . . . . . . . 31.8 m-20 -73.57 -44.51 57.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.157 -0.474 . . . . 64.21 110.917 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' B ARG . . . . . . . . . . . . . 18.8 mmt180 -60.79 -169.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.484 . . . . 74.51 110.921 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -98.54 -15.9 19.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 73.22 110.905 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.98 111.97 0.54 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.783 -0.722 . . . . 72.0 112.524 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -155.43 66.77 0.31 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.723 -0.751 . . . . 71.41 112.47 -179.907 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.68 114.01 3.55 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.678 2.252 . . . . 74.31 112.351 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -116.72 -122.19 3.33 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.787 -0.721 . . . . 65.01 112.5 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -160.18 125.3 3.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.846 0.355 . . . . 75.03 110.882 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.2 p -139.98 133.29 15.23 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.609 0.719 . . . . 73.31 111.134 179.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.75 150.32 68.14 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.683 2.255 . . . . 75.23 112.378 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 21.6 t -58.0 -22.06 18.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 72.42 111.142 179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.9 m -77.97 -2.08 35.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 50.22 110.822 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -126.1 10.19 7.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 73.14 110.912 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 2.4 t -147.21 139.73 19.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.494 . . . . 73.11 111.107 179.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 31.9 ttm180 -104.97 131.21 52.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 71.14 110.904 -179.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 30.0 mm -87.16 108.94 18.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 73.23 111.126 179.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 3.1 pt -123.01 160.47 25.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 74.12 111.101 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 60.8 t0 -97.38 125.38 41.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 74.13 110.844 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mt -51.65 -37.55 50.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.476 . . . . 74.02 110.928 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.79 -31.27 35.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.141 -0.481 . . . . 73.1 110.912 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -137.69 78.32 37.22 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.606 0.717 . . . . 72.21 110.898 179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 -8.12 22.8 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.641 2.227 . . . . 61.15 112.354 -179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.84 -33.68 11.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 52.24 111.123 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.14 -51.8 59.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 72.3 110.87 179.989 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 20.3 m-85 -90.78 18.95 5.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.436 . . . . 75.04 110.933 -179.947 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -84.14 -23.06 30.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.122 -0.49 . . . . 73.22 111.11 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 47.3 t -94.6 -5.68 45.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 73.22 110.844 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 53.6 t -51.26 121.78 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.117 -0.492 . . . . 75.21 111.147 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -77.53 75.72 4.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.189 -0.46 . . . . 64.21 110.864 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -47.43 -34.16 6.91 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.446 . . . . 72.25 111.136 -179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -58.71 -44.47 90.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.218 -0.446 . . . . 75.22 110.898 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -69.09 113.98 6.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.104 -0.498 . . . . 73.13 110.866 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.22 -23.77 37.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 74.35 110.884 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -65.78 -54.98 19.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 74.03 110.872 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 4.5 mm-40 -58.67 -58.23 9.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 73.32 110.875 -179.942 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -51.61 -31.68 12.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.274 -0.421 . . . . 74.23 111.171 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 9.2 mtm -68.71 -51.11 45.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.104 -0.498 . . . . 73.31 110.846 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -56.95 -43.36 81.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.447 . . . . 74.42 110.86 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.8 mp -64.43 -53.35 43.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 74.34 111.15 179.857 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 88.5 mt -59.64 -36.65 66.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 74.33 111.113 179.819 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -71.17 -52.25 20.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 75.25 110.891 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -60.77 -50.84 71.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 72.13 110.894 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -67.82 -15.07 63.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 75.21 110.9 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp 57.88 51.82 8.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 74.42 110.923 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 27.8 mt -77.94 131.5 69.91 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.658 0.742 . . . . 74.4 111.123 179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 152.0 69.29 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.661 2.24 . . . . 74.33 112.352 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.73 170.24 15.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 75.0 111.188 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 95.2 t -52.01 -55.2 10.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.253 -0.43 . . . . 70.31 111.166 179.896 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -51.95 -46.42 64.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.142 -0.481 . . . . 70.34 110.868 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 58.7 mm-40 -59.68 -42.7 93.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 74.24 110.936 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 25.3 t90 -64.94 -38.26 90.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 74.44 110.925 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.86 -49.54 70.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 75.52 110.923 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -61.65 -45.44 94.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.45 . . . . 73.23 110.843 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -58.78 -51.67 68.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 74.12 110.881 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 5.5 p -59.5 -46.01 90.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.156 -0.474 . . . . 73.34 111.182 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 20.2 mmt180 -57.16 -45.41 83.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.252 -0.431 . . . . 75.35 110.857 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 33.0 mtp180 -69.45 -32.29 71.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 75.45 110.888 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -68.51 -37.56 80.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 75.5 110.971 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 61.0 mmtt -81.93 -23.77 35.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.065 -0.516 . . . . 74.22 110.883 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -93.55 136.31 33.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.256 -0.429 . . . . 74.14 110.933 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.7 t 63.51 46.57 4.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.476 . . . . 72.4 110.87 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 16.8 m -62.43 -170.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.092 -0.504 . . . . 64.42 110.857 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 43.0 mm -51.59 145.84 2.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.124 -0.489 . . . . 74.45 111.133 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -171.52 -173.35 1.2 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.142 -0.481 . . . . 71.31 110.867 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.7 mt -111.47 146.26 16.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 75.11 111.088 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -52.41 137.48 34.13 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.721 -0.752 . . . . 75.42 112.49 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -91.62 149.78 21.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.842 0.353 . . . . 74.44 110.895 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -52.39 171.9 0.39 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.724 -0.75 . . . . 51.42 112.514 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -52.84 -29.32 27.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.82 0.343 . . . . 73.22 110.856 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -83.55 54.18 4.93 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.727 -0.749 . . . . 42.12 112.527 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -176.73 122.78 0.15 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.792 0.329 . . . . 73.52 110.916 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 51.3 m -96.03 143.05 27.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 71.31 110.866 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 19.4 mp0 -88.9 -74.52 0.46 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 74.52 110.932 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 86.36 53.78 2.86 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.726 -0.749 . . . . 74.22 112.474 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.04 175.24 9.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.796 0.331 . . . . 64.4 110.919 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.469 . . . . 72.54 110.872 179.949 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 N-CA-C 112.477 -0.249 . . . . 74.03 112.477 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.46 45.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.873 0.368 . . . . 75.43 110.888 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -84.04 -76.38 0.3 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 74.55 110.902 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 22.3 mm 50.51 80.3 0.3 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.661 0.743 . . . . 73.31 111.138 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 113.49 3.39 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.668 2.245 . . . . 73.15 112.351 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -123.92 56.6 1.23 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 51.32 110.82 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -109.94 163.59 16.77 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.591 0.71 . . . . 73.21 110.873 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.84 -6.46 18.69 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.655 2.237 . . . . 74.35 112.359 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 51.47 88.13 0.12 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.554 0.692 . . . . 74.52 111.105 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.76 126.6 13.5 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.678 2.252 . . . . 61.13 112.371 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 19.2 mtmm -66.34 160.1 67.94 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.532 0.682 . . . . 75.32 110.931 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 167.32 24.76 Favored 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.719 2.279 . . . . 75.53 112.372 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 129.47 17.64 Favored 'Trans proline' 0 N--CA 1.466 -0.141 0 C-N-CA 122.719 2.279 . . . . 70.34 112.322 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 1.7 t -164.04 146.34 9.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 72.35 110.835 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 3.7 t -68.93 -27.68 65.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.1 -0.5 . . . . 74.01 110.835 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 74.43 111.064 179.897 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 2.7 ttt . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.813 0.339 . . . . 73.42 110.838 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -92.84 160.35 34.18 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.568 0.699 . . . . 74.51 111.148 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 115.46 4.1 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 122.708 2.272 . . . . 73.43 112.297 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.9 pp -122.21 134.43 54.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 73.35 110.942 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -117.45 163.61 16.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 73.31 110.881 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -134.93 164.13 28.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 64.55 111.118 179.925 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.6 p -131.6 131.09 62.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 74.02 111.148 179.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -72.87 136.56 45.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.194 -0.457 . . . . 73.23 111.137 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 17.4 mt -108.37 -16.07 14.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 75.31 110.917 179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -135.35 161.85 34.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.451 . . . . 75.43 110.909 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -84.35 105.02 14.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.085 -0.507 . . . . 73.31 110.895 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -89.61 100.24 13.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 74.45 110.912 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -80.23 106.85 12.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 75.42 110.868 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.23 152.83 16.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 75.34 111.098 179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -113.73 -30.97 6.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.242 -0.435 . . . . 73.34 110.92 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.5 mmp_? -121.21 -179.85 4.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.136 -0.484 . . . . 74.21 110.906 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -64.12 -39.1 93.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.456 . . . . 75.2 110.844 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -63.11 -50.82 69.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.443 . . . . 72.33 110.865 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -55.07 135.65 48.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 72.35 110.894 -179.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.7 tp -108.37 136.93 47.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 74.1 110.907 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -85.18 128.68 34.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 64.23 110.859 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 7.1 p -140.19 143.3 29.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 74.25 111.127 179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -101.81 160.36 26.7 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.688 0.756 . . . . 74.04 110.836 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 121.79 8.48 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.711 2.274 . . . . 75.35 112.319 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.12 5.69 30.36 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.701 -0.761 . . . . 72.14 112.479 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -92.2 169.2 10.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.883 0.373 . . . . 72.41 110.884 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -113.51 123.33 49.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 74.14 110.836 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.4 mp -123.18 150.12 43.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.109 -0.496 . . . . 74.43 110.929 179.956 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.94 112.92 26.17 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.175 -0.466 . . . . 73.14 110.832 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 59.6 mt -76.77 145.36 10.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 75.44 111.17 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.7 m -119.51 -32.6 4.29 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.137 -0.483 . . . . 75.41 110.874 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -170.04 174.09 5.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 51.51 111.08 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -123.77 178.02 5.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 74.45 110.844 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -150.66 104.67 3.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 65.42 110.912 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 59.93 17.75 6.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.111 -0.495 . . . . 72.34 110.859 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 24.1 m-85 60.97 20.82 11.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 73.22 110.902 -179.871 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -117.68 -24.42 7.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 71.43 110.912 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 81.3 m95 -132.23 135.81 46.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.107 -0.497 . . . . 75.13 110.902 -179.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -118.08 131.99 56.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.202 -0.453 . . . . 74.54 110.877 -179.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.4 mm -89.13 94.74 4.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 71.53 111.142 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -115.54 152.34 33.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.457 . . . . 63.44 111.085 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.0 ptpp? -122.44 157.05 60.05 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.563 0.696 . . . . 73.14 110.908 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 136.7 33.76 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.683 2.255 . . . . 75.1 112.372 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 69.1 mt -106.27 -44.1 7.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 64.5 111.155 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' A ASN . . . . . . . . . . . . . 7.9 t-20 -57.11 -74.7 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.157 -0.474 . . . . 72.33 110.904 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' B ARG . . . . . . . . . . . . . 7.6 ptp85 -79.86 -177.26 5.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 71.43 110.852 -179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -123.46 113.63 19.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 74.11 110.891 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -146.51 -73.42 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.765 -0.731 . . . . 75.22 112.476 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 166.68 165.48 24.13 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.754 -0.736 . . . . 74.4 112.496 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 140.4 42.57 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.717 2.278 . . . . 73.44 112.321 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -129.63 -138.29 4.39 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.753 -0.737 . . . . 52.44 112.472 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -148.46 126.88 12.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.86 0.362 . . . . 75.43 110.885 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.5 p -136.8 133.45 18.85 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.597 0.713 . . . . 73.14 111.126 179.82 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 158.4 57.06 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.665 2.244 . . . . 73.42 112.349 179.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 6.9 t -70.09 -20.57 23.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 71.2 111.138 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.9 m -81.24 3.82 22.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 62.22 110.853 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 17.0 m-85 -131.94 22.1 4.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.474 . . . . 65.32 110.918 -179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.8 m -152.14 160.34 3.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 74.22 111.163 179.905 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.4 ttp180 -127.62 120.56 28.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.228 -0.442 . . . . 73.05 110.89 -179.972 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.6 mm -71.9 123.03 25.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 74.2 111.083 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 16.0 pt -141.86 172.07 10.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 74.35 111.143 179.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 48.8 t0 -119.42 129.74 54.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.466 . . . . 74.42 110.883 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.6 mt -53.57 -27.73 27.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 73.33 110.908 -179.908 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.2 mmt -88.01 -31.69 19.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 75.24 110.864 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -139.44 73.7 35.73 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.596 0.712 . . . . 73.24 110.863 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 -8.58 23.97 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.731 2.288 . . . . 73.4 112.331 -179.976 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -103.33 -12.8 17.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 74.44 111.091 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -75.23 -51.77 12.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.45 . . . . 72.32 110.906 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 61.6 m-85 -96.77 23.13 7.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 74.24 110.943 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -85.83 -18.64 32.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 74.32 111.135 179.839 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 35.6 t -94.21 -23.42 17.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 63.11 110.904 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 7.4 p -51.29 154.83 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.119 -0.492 . . . . 74.22 111.118 179.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -107.89 110.24 21.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 73.13 110.853 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.65 -38.88 70.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 75.5 111.145 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -55.11 -42.16 72.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.197 -0.456 . . . . 75.03 110.925 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 52.9 t0 -63.9 105.66 0.88 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 74.14 110.924 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.01 -29.24 20.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 72.43 110.845 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -66.98 -56.17 11.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 74.12 110.862 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -59.1 -55.07 39.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 71.04 110.905 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 5.4 p -54.24 -32.7 24.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 75.03 111.138 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.3 mtm -67.3 -55.68 12.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 71.34 110.9 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.8 mttm -55.02 -38.25 67.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.438 . . . . 73.02 110.883 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 34.4 mt -65.46 -54.88 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 75.31 111.132 179.909 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 96.8 mt -61.0 -36.1 69.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.139 -0.482 . . . . 64.04 111.149 179.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -71.03 -47.68 57.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 74.32 110.861 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -63.03 -52.36 63.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.162 -0.472 . . . . 64.13 110.88 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -67.87 -15.8 63.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 75.12 110.866 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.6 mmtm 60.95 62.07 1.51 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.484 . . . . 75.15 110.944 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 54.7 mt -92.05 132.42 32.6 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.615 0.722 . . . . 53.43 111.144 179.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 169.93 17.84 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.707 2.272 . . . . 73.42 112.314 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -106.07 177.73 4.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 70.45 111.115 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.5 t -59.82 -52.79 56.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.204 -0.453 . . . . 74.35 111.118 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -54.15 -52.65 60.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 72.31 110.874 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -60.64 -38.78 85.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.156 -0.475 . . . . 74.31 110.937 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 31.2 t90 -66.45 -37.91 86.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.21 -0.45 . . . . 71.53 110.879 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.3 mmpt? -66.95 -49.38 65.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.273 -0.422 . . . . 74.42 110.899 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -61.74 -43.57 98.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 75.21 110.882 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -61.0 -52.91 63.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 73.43 110.89 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.9 p -59.99 -35.85 75.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 75.31 111.166 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 2.1 mmt85 -65.53 -54.98 20.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 73.11 110.887 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 -68.97 -19.48 64.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 73.12 110.882 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -87.23 -26.89 23.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 75.23 110.931 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? -87.63 -25.35 23.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.076 -0.511 . . . . 73.42 110.893 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -51.74 168.57 0.08 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 72.24 110.914 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 47.1 t -54.42 116.95 2.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 63.22 110.86 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 97.8 p -143.29 -171.15 3.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.131 -0.486 . . . . 61.14 110.887 -179.858 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 39.4 mm -53.46 141.13 8.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 75.42 111.094 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.6 pp0? -174.92 157.29 2.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 74.1 110.955 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -147.02 101.02 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 64.51 111.09 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 164.1 -144.73 9.69 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.757 -0.735 . . . . 32.33 112.475 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 9.3 p-10 -113.65 138.35 50.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.898 0.38 . . . . 53.14 110.87 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 174.27 -156.09 22.69 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.728 -0.749 . . . . 74.34 112.496 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 46.9 m80 -142.23 178.93 7.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.803 0.335 . . . . 74.14 110.851 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -103.57 -166.63 25.43 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.688 -0.768 . . . . 73.14 112.486 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.5 mp0 -130.38 -174.74 3.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.83 0.348 . . . . 75.05 110.951 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.5 m -137.38 174.61 10.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.246 -0.434 . . . . 72.34 110.836 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -104.12 -174.98 2.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.125 -0.488 . . . . 74.54 110.954 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.452 ' O ' ' C ' ' A' ' 116' ' ' LEU . . . -129.54 -90.72 0.61 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.706 -0.759 . . . . 53.02 112.497 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.452 ' C ' ' O ' ' A' ' 115' ' ' GLY . 0.4 OUTLIER 33.39 48.16 0.17 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.79 0.329 . . . . 75.4 110.941 -179.936 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 10.6 tm-20 . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.152 -0.476 . . . . 75.34 110.897 179.948 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.454 -0.258 . . . . 71.24 112.454 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 20.0 tttm -133.94 -47.35 0.79 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.79 0.329 . . . . 65.01 110.899 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 38.2 m-85 -90.08 -71.8 0.6 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 75.34 110.895 179.968 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.6 mm 54.65 77.88 0.42 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.588 0.709 . . . . 72.31 111.155 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 87.49 0.56 Allowed 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.688 2.258 . . . . 72.33 112.294 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 33.5 t -104.01 34.17 3.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 55.43 110.859 -179.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 2.5 mtp85 -95.83 161.07 28.7 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.64 0.733 . . . . 74.03 110.852 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 111.03 2.69 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.671 2.247 . . . . 74.41 112.342 -179.966 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -50.09 108.2 0.96 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.595 0.712 . . . . 73.11 111.104 179.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.81 145.69 57.6 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.73 2.287 . . . . 72.33 112.311 -179.954 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -97.3 137.49 21.17 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.536 0.684 . . . . 74.11 110.903 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 165.67 30.21 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.647 2.231 . . . . 72.25 112.379 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 97.77 0.66 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.688 2.259 . . . . 74.23 112.327 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 72.7 m -77.05 -61.85 1.85 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 72.14 110.816 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 33.4 t -123.28 89.56 3.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.096 -0.502 . . . . 64.4 110.863 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 54.21 111.058 179.94 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 17.2 tpt . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.809 0.338 . . . . 75.23 110.923 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -156.65 159.86 31.09 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.55 0.69 . . . . 74.44 111.084 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 75.36 1.23 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.653 2.236 . . . . 75.44 112.349 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -74.16 140.33 45.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 75.22 110.938 179.995 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 16.6 m-30 -117.37 139.43 50.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 72.43 110.858 179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -109.7 170.11 8.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 72.14 111.093 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.95 125.89 58.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 74.31 111.133 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -71.84 135.45 46.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 71.03 111.14 -179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 40.3 mt -105.56 -16.34 14.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.246 -0.434 . . . . 61.44 110.89 179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -138.39 158.3 44.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 74.2 110.912 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -84.27 104.74 14.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.07 -0.514 . . . . 63.31 110.875 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -97.17 123.36 40.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 74.34 110.846 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.73 121.13 40.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 74.43 110.892 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.46 164.9 8.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.223 -0.444 . . . . 74.41 111.09 179.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -116.44 -29.49 6.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.21 -0.45 . . . . 72.12 110.899 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 -135.89 -176.18 4.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 73.2 110.828 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -63.5 -43.23 97.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 71.53 110.858 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.06 -53.15 59.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.466 . . . . 74.43 110.876 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -67.42 149.41 50.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.156 -0.474 . . . . 65.12 110.901 -179.895 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.1 tp -121.17 154.16 36.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.484 . . . . 70.41 110.909 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -94.34 148.16 22.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.186 -0.461 . . . . 73.01 110.862 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 0.1 OUTLIER -144.4 159.22 15.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 64.3 111.133 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -124.51 157.0 66.79 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.675 0.75 . . . . 74.3 110.861 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 117.68 5.23 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.726 2.284 . . . . 73.22 112.309 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.93 5.2 33.42 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.68 -0.771 . . . . 71.23 112.481 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -91.84 151.67 20.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.819 0.342 . . . . 74.24 110.905 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -100.69 113.36 26.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 72.52 110.878 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 4.1 mp -112.33 168.22 9.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.15 -0.477 . . . . 74.12 110.949 179.948 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.9 t -121.52 116.15 24.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.455 . . . . 71.14 110.843 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 27.9 mm -68.55 147.63 12.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 72.42 111.101 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 27.7 m -125.43 -37.05 2.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 74.14 110.875 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -170.25 171.76 6.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 61.21 111.123 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.9 p80 -126.44 175.45 7.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.231 -0.44 . . . . 72.23 110.844 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -147.01 102.17 3.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 74.22 110.927 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 60.9 18.18 8.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.495 . . . . 64.21 110.85 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 62.1 19.82 11.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.177 -0.465 . . . . 72.43 110.931 -179.844 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -119.03 -4.24 10.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.081 -0.509 . . . . 75.13 110.833 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -150.01 135.7 18.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.139 -0.482 . . . . 74.21 110.878 -179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -121.9 144.91 48.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 74.4 110.842 -179.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 11.7 mm -103.51 94.88 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.483 . . . . 75.43 111.141 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -110.19 139.49 45.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 75.23 111.123 179.777 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 pttp -115.33 157.11 44.73 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.547 0.689 . . . . 75.3 110.918 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 108.39 2.07 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.664 2.242 . . . . 72.41 112.328 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 62.3 mt -68.71 -26.88 34.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 70.03 111.156 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' A ASN . . . . . . . . . . . . . 29.1 m-20 -87.16 -60.86 1.86 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 73.32 110.895 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' B ARG . . . . . . . . . . . . . 33.0 mtp180 -60.75 -169.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 72.31 110.86 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 65.0 mt -83.72 -174.46 5.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.217 -0.447 . . . . 74.32 110.9 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.94 111.32 3.99 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.741 -0.743 . . . . 74.5 112.503 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -152.03 66.66 0.34 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.726 -0.75 . . . . 72.51 112.467 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 124.94 11.59 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.708 2.272 . . . . 64.15 112.331 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -128.85 -136.93 4.24 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.756 -0.735 . . . . 75.24 112.485 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -144.86 126.87 15.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.869 0.366 . . . . 65.12 110.876 -179.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.3 p -140.53 132.8 14.4 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.617 0.722 . . . . 73.25 111.107 179.861 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 151.04 68.84 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.683 2.255 . . . . 75.55 112.37 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 15.9 t -61.97 -21.67 26.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.243 -0.435 . . . . 74.33 111.133 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.9 t -77.56 -4.11 44.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 64.14 110.856 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -122.45 15.21 10.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.123 -0.489 . . . . 73.22 110.92 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.8 m -151.42 156.33 6.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 64.45 111.084 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.1 ttm180 -125.52 124.56 41.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 74.32 110.865 -179.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 40.7 mm -74.72 108.98 6.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 73.01 111.143 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.1 pt -126.45 167.93 20.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 74.24 111.176 179.879 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -107.89 119.72 40.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.206 -0.452 . . . . 75.24 110.88 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -50.78 -30.83 15.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 70.11 110.877 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.8 mtm -81.72 -34.75 30.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 65.24 110.898 179.843 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -141.02 76.3 22.46 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.596 0.712 . . . . 75.25 110.818 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.84 -7.84 22.08 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.707 2.271 . . . . 72.32 112.303 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.77 -12.37 25.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 61.33 111.095 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.9 ttmt -84.31 -51.06 7.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.261 -0.427 . . . . 73.15 110.917 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 -94.98 23.25 5.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.175 -0.466 . . . . 73.13 110.935 -179.953 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -86.57 -18.16 32.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.103 -0.498 . . . . 75.44 111.136 179.856 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 9.6 p -93.18 -16.07 25.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 71.01 110.882 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 9.9 p -51.08 144.36 2.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.118 -0.492 . . . . 72.52 111.126 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -103.78 86.5 2.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.166 -0.47 . . . . 75.41 110.844 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -51.71 -29.95 20.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 75.13 111.142 -179.887 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -59.41 -47.99 83.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 75.32 110.905 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -64.05 112.22 2.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 71.41 110.856 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.66 -26.68 34.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 73.13 110.877 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -66.33 -49.59 66.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 74.11 110.921 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 3.1 mm100 -61.74 -56.07 23.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 75.51 110.931 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -55.69 -30.83 27.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 72.41 111.134 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.3 mtm -67.83 -56.89 7.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 73.35 110.876 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 44.4 mttt -57.36 -36.3 71.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 72.54 110.942 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 24.7 mt -65.72 -51.38 62.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 71.02 111.116 179.901 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 95.9 mt -61.03 -34.79 61.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.13 -0.486 . . . . 75.45 111.145 179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -71.19 -47.29 58.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.476 . . . . 74.32 110.858 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -66.47 -45.68 78.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.199 -0.455 . . . . 73.22 110.927 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -73.98 -10.33 59.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.142 -0.481 . . . . 74.34 110.839 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.36 44.37 18.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.131 -0.486 . . . . 74.24 110.935 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 16.1 mt -77.25 120.3 81.0 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.597 0.713 . . . . 73.41 111.16 179.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.83 166.63 27.04 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.685 2.257 . . . . 72.3 112.311 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -90.66 169.96 10.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 74.31 111.149 -179.971 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.7 t -51.42 -57.73 2.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.207 -0.451 . . . . 74.03 111.138 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -51.35 -44.27 62.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.203 -0.453 . . . . 75.23 110.887 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 71.0 mm-40 -62.19 -46.26 89.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.13 -0.486 . . . . 73.15 110.952 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -61.13 -40.13 92.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 72.24 110.951 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -64.15 -51.68 62.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 72.31 110.929 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -58.84 -39.5 81.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 74.5 110.883 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -62.7 -53.58 52.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 74.13 110.891 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -62.58 -38.73 91.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.446 . . . . 74.34 111.166 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 24.9 mmt180 -62.44 -59.34 5.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.255 -0.429 . . . . 75.33 110.867 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 27.4 ptt180 -60.29 -32.39 71.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 74.12 110.823 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -65.19 -47.04 78.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.216 -0.447 . . . . 73.24 110.935 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.18 -25.55 68.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 74.44 110.909 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -104.73 -176.44 3.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.223 -0.444 . . . . 75.1 110.85 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.1 t -129.68 151.15 50.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.107 -0.497 . . . . 75.15 110.854 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 61.3 p -124.75 -174.24 2.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.102 -0.499 . . . . 74.55 110.857 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 23.1 mm -67.8 -21.86 27.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 71.11 111.165 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -92.42 174.12 7.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 75.3 110.875 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -147.58 160.68 8.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.22 -0.446 . . . . 73.52 111.15 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 82.58 167.1 39.94 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.731 -0.747 . . . . 54.24 112.552 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -113.92 141.27 47.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.94 0.4 . . . . 63.05 110.868 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -77.06 100.79 1.52 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.703 -0.761 . . . . 74.53 112.481 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -151.35 136.27 17.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.804 0.335 . . . . 71.2 110.882 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -135.95 171.53 22.7 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.746 -0.74 . . . . 71.34 112.542 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -110.42 -179.6 3.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.83 0.348 . . . . 70.03 110.88 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.5 p -135.91 167.34 21.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 73.42 110.846 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -165.51 139.05 4.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.078 -0.51 . . . . 72.43 110.894 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -133.45 21.64 4.03 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.779 -0.724 . . . . 63.15 112.493 -179.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 1.7 mp 52.15 37.25 21.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.799 0.333 . . . . 75.02 110.903 -179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.201 -0.454 . . . . 75.44 110.892 179.909 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.479 -0.248 . . . . 61.22 112.479 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.09 6.11 5.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.834 0.349 . . . . 73.11 110.935 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 39.4 m-85 -95.31 -76.83 0.48 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.44 . . . . 73.43 110.888 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 12.8 mm 49.1 78.35 0.41 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.577 0.703 . . . . 73.15 111.165 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 82.37 0.75 Allowed 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.692 2.261 . . . . 75.43 112.377 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -90.68 47.84 1.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 74.52 110.88 -179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -105.13 163.21 17.62 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.645 0.736 . . . . 72.23 110.851 -179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 -5.98 17.5 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.684 2.256 . . . . 74.13 112.332 179.988 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 51.22 89.4 0.1 OUTLIER Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.543 0.687 . . . . 75.13 111.094 179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 129.63 17.95 Favored 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.705 2.27 . . . . 63.14 112.36 -179.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -70.6 160.44 81.65 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.585 0.707 . . . . 74.23 110.901 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 166.39 27.79 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.693 2.262 . . . . 74.0 112.353 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 115.82 4.27 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.65 2.233 . . . . 74.13 112.346 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 38.7 t -119.25 58.3 0.87 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.226 -0.443 . . . . 72.41 110.858 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 19.7 m -53.8 132.79 42.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.083 -0.508 . . . . 75.11 110.868 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 43.51 111.072 179.908 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 4.7 ppp? . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.778 0.323 . . . . 72.31 110.902 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -80.49 160.16 68.0 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.604 0.716 . . . . 73.23 111.086 179.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 97.43 0.64 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.733 2.289 . . . . 71.15 112.287 -179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.5 pp -100.18 139.27 36.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.224 -0.443 . . . . 73.15 110.899 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -122.47 163.11 20.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.208 -0.451 . . . . 62.5 110.884 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -135.02 163.39 29.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 71.13 111.117 179.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.5 p -127.43 124.95 64.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 71.44 111.092 179.994 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -68.72 145.67 53.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 70.41 111.117 -179.999 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 15.7 mt -114.46 -13.74 12.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 74.25 110.857 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -138.33 170.22 16.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 73.14 110.931 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -92.68 104.92 17.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 73.2 110.881 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 26.8 t80 -86.9 104.48 16.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 72.31 110.868 -179.905 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.8 mttp -80.92 101.03 9.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.127 -0.488 . . . . 73.24 110.918 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.15 141.76 17.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 74.11 111.089 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -111.68 -28.76 7.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.203 -0.453 . . . . 71.51 110.85 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 34.0 mmt180 -127.11 -178.11 4.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 73.44 110.854 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -66.95 -37.33 84.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 74.21 110.888 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -67.91 -30.23 69.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 70.3 110.856 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -81.6 135.03 35.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 71.54 110.883 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.9 tp -108.11 150.12 27.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.127 -0.488 . . . . 73.33 110.921 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -91.73 123.26 34.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 70.41 110.868 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.2 p -133.09 156.63 42.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.201 -0.454 . . . . 73.41 111.095 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.93 158.55 40.41 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.709 0.766 . . . . 74.41 110.808 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 118.71 5.85 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.71 2.273 . . . . 70.12 112.341 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.04 -1.41 38.21 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.721 -0.752 . . . . 74.51 112.485 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -83.83 162.24 20.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.828 0.347 . . . . 75.24 110.92 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 6.4 m120 -100.76 132.32 46.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 75.42 110.847 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 15.2 mt -129.47 151.71 49.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.106 -0.497 . . . . 74.12 110.902 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.69 112.82 25.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 74.32 110.908 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 56.3 mt -80.67 144.44 10.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.141 -0.481 . . . . 75.41 111.139 179.971 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.5 m -117.11 -39.96 3.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.193 -0.458 . . . . 52.14 110.856 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -163.28 173.76 12.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.202 -0.454 . . . . 72.23 111.056 -179.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -119.97 177.96 4.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 74.41 110.819 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 49.8 t80 -148.2 101.17 3.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 71.14 110.912 -179.849 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 60.15 18.05 7.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 53.54 110.862 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 39.1 m-85 61.61 20.62 11.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.23 -0.441 . . . . 75.02 110.925 -179.865 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -118.25 -9.33 10.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.11 -0.496 . . . . 53.14 110.879 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 80.6 m95 -149.23 135.81 19.44 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.15 -0.477 . . . . 74.33 110.944 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -116.45 130.23 56.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.237 -0.438 . . . . 75.15 110.907 -179.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.7 mm -83.54 95.1 3.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 72.32 111.136 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -110.87 149.61 30.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 75.3 111.114 179.805 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 pttp -125.04 157.22 67.7 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.555 0.693 . . . . 75.21 110.935 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 135.97 31.7 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.642 2.228 . . . . 74.44 112.335 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 57.2 mt -98.69 -22.98 4.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 72.13 111.167 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' A ASN . . . . . . . . . . . . . 2.6 m120 -88.39 -69.64 0.69 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.139 -0.482 . . . . 71.51 110.897 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' B ARG . . . . . . . . . . . . . 10.9 ptp180 -66.15 162.65 19.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 74.44 110.875 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.49 13.9 29.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 74.52 110.899 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -51.17 -88.0 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.714 -0.755 . . . . 70.21 112.484 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 176.5 170.7 39.41 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.715 -0.755 . . . . 72.25 112.481 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 148.81 65.71 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.647 2.231 . . . . 63.33 112.318 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.5 -141.93 4.55 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.705 -0.76 . . . . 73.12 112.485 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -146.24 131.26 18.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.828 0.347 . . . . 74.41 110.939 -179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.5 p -142.41 133.58 12.93 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.606 0.717 . . . . 72.34 111.196 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 152.69 69.39 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.649 2.233 . . . . 74.11 112.309 179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 13.1 t -64.85 -21.75 30.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.467 . . . . 70.11 111.145 179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.4 t -77.09 -3.07 37.37 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.474 . . . . 74.34 110.863 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -125.09 18.22 8.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 72.31 110.878 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 13.6 m -148.96 159.86 5.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 72.54 111.077 179.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 18.4 ttm180 -127.28 112.31 14.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 75.44 110.894 179.993 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 35.2 mm -64.66 114.14 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.459 . . . . 73.52 111.11 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 1.5 pt -133.52 137.69 52.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 74.14 111.177 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -75.13 122.23 23.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.163 -0.471 . . . . 75.44 110.877 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.4 mt -52.02 -32.79 35.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 75.31 110.93 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 8.5 mmt -83.06 -29.16 29.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.474 . . . . 75.5 110.845 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -145.3 78.95 11.91 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 121.618 0.723 . . . . 75.03 110.905 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 -7.73 21.82 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.678 2.252 . . . . 73.11 112.306 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.15 -7.89 37.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.258 -0.428 . . . . 74.43 111.123 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.4 mtpt -84.12 -52.11 6.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 74.55 110.9 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 12.7 m-85 -97.64 23.73 7.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.204 -0.453 . . . . 74.32 110.941 -179.949 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -84.88 -17.06 39.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.088 -0.505 . . . . 62.25 111.053 179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 38.0 m -97.87 -18.36 18.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 61.23 110.856 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 7.3 p -51.2 144.84 2.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.105 -0.498 . . . . 75.11 111.127 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -99.14 87.28 3.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.133 -0.485 . . . . 74.22 110.908 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -51.92 -34.62 42.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.452 . . . . 73.22 111.203 -179.875 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -58.22 -45.02 88.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 75.13 110.937 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -63.5 109.14 1.54 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.115 -0.493 . . . . 73.52 110.921 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.61 -26.24 31.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 73.05 110.868 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -67.01 -52.85 37.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 73.13 110.895 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -60.99 -56.42 21.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 72.41 110.931 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 1.5 p -53.7 -31.49 20.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.464 . . . . 73.3 111.135 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 12.3 mtm -68.06 -56.54 8.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.461 . . . . 75.42 110.86 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.1 mttt -55.05 -37.42 66.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.19 -0.459 . . . . 75.42 110.891 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 48.0 mt -66.32 -52.67 44.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.431 . . . . 73.41 111.157 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 96.5 mt -61.96 -35.8 70.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 72.53 111.133 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -69.9 -47.66 61.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.139 -0.482 . . . . 61.23 110.853 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -64.25 -49.25 72.65 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 75.54 110.883 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -68.04 -14.71 63.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 73.33 110.907 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.5 mmtp 60.46 55.81 3.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 73.23 110.941 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 31.4 mt -88.41 126.09 61.45 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.623 0.725 . . . . 72.01 111.159 179.848 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 163.8 36.9 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.709 2.273 . . . . 72.12 112.361 179.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.95 172.11 8.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 73.24 111.132 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 88.2 t -51.34 -54.31 12.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.451 . . . . 74.32 111.117 179.922 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -50.5 -47.5 57.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 73.35 110.888 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 45.4 mm-40 -62.96 -41.89 99.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.096 -0.502 . . . . 72.12 110.899 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 24.2 t90 -65.19 -39.99 93.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.2 -0.454 . . . . 74.23 110.94 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.82 -49.54 70.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.276 -0.42 . . . . 74.43 110.916 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -63.16 -37.73 88.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 74.25 110.89 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -63.49 -52.04 63.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 73.24 110.915 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -60.98 -43.89 98.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.171 -0.468 . . . . 74.33 111.117 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 8.9 mmt-85 -58.34 -57.69 11.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 73.33 110.868 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 29.7 ptt180 -62.72 -28.43 69.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 75.34 110.892 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -66.61 -45.97 77.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.219 -0.446 . . . . 75.44 110.873 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.1 mtpp -57.23 -25.78 59.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.141 -0.481 . . . . 75.12 110.91 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -65.8 -172.52 0.13 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 54.34 110.846 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 55.81 36.04 26.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.11 -0.495 . . . . 63.14 110.858 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 63.1 m -61.13 129.6 42.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.102 -0.499 . . . . 64.31 110.876 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 16.7 mt 69.62 21.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.458 . . . . 72.13 111.101 179.917 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -128.6 -169.61 2.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 70.23 110.94 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.3 mp -130.16 -63.97 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.233 -0.44 . . . . 74.25 111.11 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 78.11 -139.22 22.37 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.731 -0.747 . . . . 62.22 112.51 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -111.32 146.38 37.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.877 0.37 . . . . 72.41 110.925 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 154.51 -30.74 0.69 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.77 -0.729 . . . . 73.04 112.519 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -81.42 -43.66 18.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.893 0.378 . . . . 73.2 110.855 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 67.29 -138.87 34.86 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.744 -0.741 . . . . 70.11 112.474 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -134.89 169.19 17.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.776 0.322 . . . . 71.33 110.945 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 12.9 m -110.37 -176.96 3.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 75.2 110.853 -179.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 23.0 mm100 -87.9 -65.95 0.96 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.495 . . . . 74.13 110.908 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 72.67 100.55 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.771 -0.728 . . . . 75.23 112.515 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 63.9 mt -94.93 -176.75 3.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.768 0.318 . . . . 75.13 110.938 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.195 -0.457 . . . . 65.35 110.842 179.954 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 N-CA-C 112.46 -0.256 . . . . 75.02 112.46 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.41 -61.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.808 0.337 . . . . 64.23 110.919 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -85.64 -80.25 0.22 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.466 . . . . 65.52 110.87 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 58.1 mt 45.46 84.47 0.19 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.638 0.732 . . . . 75.54 111.099 179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 127.51 14.67 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.666 2.244 . . . . 64.21 112.339 179.89 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -114.03 0.73 14.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.239 -0.437 . . . . 75.51 110.874 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -50.63 163.82 0.45 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.635 0.731 . . . . 64.13 110.849 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -16.22 37.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.651 2.234 . . . . 73.54 112.377 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.1 84.65 0.18 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.549 0.69 . . . . 70.33 111.12 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 138.02 36.94 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.679 2.253 . . . . 65.42 112.351 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -71.4 160.69 81.81 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.572 0.701 . . . . 73.31 110.895 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 167.6 24.0 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.635 2.223 . . . . 64.55 112.33 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 -25.32 28.88 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.66 2.24 . . . . 70.33 112.382 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 50.0 m -80.32 68.34 6.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 75.14 110.847 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 49.2 m -104.21 -40.43 6.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.114 -0.493 . . . . 61.43 110.85 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.123 -0.49 . . . . 75.41 111.107 179.914 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.79 0.329 . . . . 73.11 110.853 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' -1' ' ' ALA . . . . . . . . . . . . . . . -133.96 160.43 68.58 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.596 0.712 . . . . 63.21 111.08 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.87 119.82 6.69 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.662 2.241 . . . . 75.3 112.355 -179.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -117.49 156.18 28.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 75.13 110.907 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 50.1 m-85 -129.8 161.49 30.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 72.41 110.874 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -136.39 161.64 35.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 73.34 111.09 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 8.7 p -130.76 128.07 62.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.466 . . . . 75.11 111.104 -179.999 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -74.32 139.63 44.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.173 -0.467 . . . . 73.2 111.153 179.988 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 9.9 mt -114.9 -15.4 11.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 75.0 110.866 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -135.07 158.2 44.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 74.34 110.918 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -84.38 105.14 14.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.088 -0.506 . . . . 74.4 110.878 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -88.31 117.98 27.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 72.24 110.915 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.7 mttt -93.47 113.18 25.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 73.12 110.845 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -66.36 156.71 33.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 73.51 111.099 179.78 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -115.66 -28.55 6.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 73.1 110.867 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.6 mmm180 -133.09 174.55 10.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 74.53 110.856 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -58.85 -40.99 85.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 73.33 110.877 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -60.32 -25.89 66.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.172 -0.467 . . . . 71.31 110.871 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -87.62 139.41 30.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.452 . . . . 74.2 110.908 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tp -116.11 123.27 47.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.182 -0.463 . . . . 70.31 110.913 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -74.26 145.73 43.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.184 -0.462 . . . . 71.14 110.874 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 9.9 p -147.35 156.78 10.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.232 -0.44 . . . . 72.33 111.136 -179.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -113.2 158.45 38.11 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.649 0.738 . . . . 74.35 110.855 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 125.32 12.02 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.681 2.254 . . . . 62.52 112.358 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.16 -6.84 32.49 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.717 -0.754 . . . . 71.4 112.496 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -87.74 143.99 26.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.855 0.36 . . . . 71.13 110.882 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -97.07 120.56 37.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 65.32 110.915 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' LEU . . . . . . . . . . . . . 2.9 mp -111.89 157.44 20.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 72.22 110.873 179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.33 112.85 25.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 74.41 110.836 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 29.7 mm -69.68 143.5 14.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 73.42 111.097 179.968 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.5 m -121.4 -39.7 2.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.15 -0.477 . . . . 74.22 110.925 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -173.89 173.43 3.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.474 . . . . 72.01 111.105 179.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -120.87 176.19 5.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 63.41 110.876 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' TYR . . . . . 0.413 ' HB3' ' HB2' ' A' ' 36' ' ' TRP . 29.7 t80 -146.59 101.01 3.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.198 -0.455 . . . . 74.51 110.941 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . 0.427 ' HB3' ' CG ' ' A' ' 35' ' ' GLU . 38.0 t0 61.44 16.45 7.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 71.3 110.903 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 63.76 30.06 14.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 72.14 110.908 -179.825 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.427 ' CG ' ' HB3' ' A' ' 33' ' ' ASP . 3.6 pt-20 -132.21 -1.57 3.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.158 -0.474 . . . . 72.44 110.906 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.413 ' HB2' ' HB3' ' A' ' 32' ' ' TYR . 85.5 m95 -152.75 135.46 15.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.155 -0.475 . . . . 74.42 110.938 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -121.72 139.0 54.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.289 -0.414 . . . . 72.21 110.886 -179.991 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 12.9 mm -93.31 94.79 4.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.126 -0.488 . . . . 75.53 111.131 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -108.75 134.87 50.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.466 . . . . 75.22 111.135 179.801 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.64 156.53 39.52 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.555 0.693 . . . . 74.3 110.914 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 124.17 10.84 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.691 2.261 . . . . 75.24 112.33 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 46.8 mt -90.19 -45.2 15.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.276 -0.42 . . . . 71.32 111.102 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' A ASN . . . . . . . . . . . . . 18.3 t-20 -74.69 -67.89 0.59 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 74.31 110.888 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' B ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.01 170.64 16.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.443 . . . . 73.24 110.886 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.42 -176.43 3.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 72.23 110.885 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 137.48 -93.89 0.22 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.723 -0.751 . . . . 72.04 112.478 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -177.88 165.71 35.44 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.751 -0.738 . . . . 64.43 112.511 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 144.32 53.38 Favored 'Trans proline' 0 C--N 1.341 0.134 0 C-N-CA 122.683 2.255 . . . . 72.45 112.312 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.22 -158.01 8.38 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.752 -0.737 . . . . 64.43 112.55 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -124.92 125.01 43.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.89 0.376 . . . . 71.21 110.915 -179.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 7.4 p -131.11 133.74 25.03 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-O 121.626 0.727 . . . . 71.2 111.12 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 153.19 69.36 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.669 2.246 . . . . 72.44 112.365 179.944 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 4.6 t -74.39 -21.14 17.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 71.35 111.151 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.9 m -76.59 -3.28 36.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 74.42 110.852 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -125.97 21.29 7.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.148 -0.478 . . . . 74.04 110.946 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 10.4 m -148.87 167.0 3.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.086 -0.506 . . . . 61.3 111.146 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 39.8 ttm-85 -138.35 119.68 14.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 73.25 110.811 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 38.8 mm -70.29 108.8 2.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.183 -0.462 . . . . 64.41 111.154 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 2.2 pt -128.31 140.3 49.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.459 . . . . 75.55 111.122 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -78.76 121.91 25.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.187 -0.46 . . . . 74.53 110.848 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -53.5 -30.02 39.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.157 -0.474 . . . . 74.3 110.892 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 14.3 mmt -85.36 -26.07 26.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 73.44 110.865 179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -148.95 77.72 9.14 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.665 0.745 . . . . 71.33 110.884 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 -7.95 22.35 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.696 2.264 . . . . 72.2 112.376 179.993 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.42 -5.98 45.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.203 -0.453 . . . . 71.31 111.15 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -84.03 -41.49 17.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 65.42 110.867 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 23.4 m-85 -111.72 23.67 13.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.213 -0.449 . . . . 73.2 110.957 -179.95 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ALA . . . . . . . . . . . . . . . -81.34 -13.4 58.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.09 -0.505 . . . . 73.23 111.13 179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.4 t -102.85 -22.22 13.91 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 64.15 110.825 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' VAL . . . . . . . . . . . . . 9.9 p -51.18 156.61 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.108 -0.496 . . . . 73.25 111.097 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -114.25 107.43 15.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 65.53 110.867 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -70.8 -25.8 63.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.153 -0.476 . . . . 72.14 111.145 -179.879 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -62.97 -47.67 82.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.225 -0.443 . . . . 72.33 110.918 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -63.83 110.16 1.99 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.136 -0.484 . . . . 65.3 110.87 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.31 -27.61 24.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 73.25 110.855 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -66.96 -54.36 22.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.445 . . . . 75.12 110.87 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -59.77 -55.75 30.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 74.34 110.878 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 5.4 p -54.05 -32.81 23.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.209 -0.451 . . . . 72.43 111.168 -179.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 15.0 mtm -67.15 -53.83 26.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.128 -0.487 . . . . 74.31 110.872 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.0 mttm -56.52 -38.37 71.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 74.21 110.891 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 16.5 mt -65.29 -52.95 45.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.456 . . . . 65.32 111.088 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' ILE . . . . . . . . . . . . . 94.7 mt -62.01 -36.48 74.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 74.13 111.151 179.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -70.19 -46.78 63.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.147 -0.479 . . . . 72.31 110.804 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -63.53 -53.64 48.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 71.42 110.878 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.2 m-85 -68.03 -14.8 63.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.132 -0.486 . . . . 75.13 110.85 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 28.6 mmtm 60.78 55.49 3.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 75.43 110.93 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' ILE . . . . . . . . . . . . . 36.0 mt -82.5 131.98 53.72 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.601 0.715 . . . . 74.23 111.193 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 166.94 25.93 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.665 2.244 . . . . 74.32 112.316 179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -97.33 168.01 10.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 73.31 111.154 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.2 t -51.41 -54.91 9.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 74.52 111.129 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -51.65 -52.06 50.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 74.12 110.846 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -57.02 -42.44 80.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 73.2 110.898 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -62.2 -39.39 92.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.218 -0.446 . . . . 74.33 110.932 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -65.12 -53.37 46.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.223 -0.444 . . . . 75.15 110.868 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -59.06 -37.23 76.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 43.41 110.872 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -64.4 -54.42 33.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 75.32 110.94 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.2 p -60.27 -44.17 95.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.208 -0.451 . . . . 70.53 111.171 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -57.99 -58.94 6.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.224 -0.444 . . . . 74.24 110.872 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -57.04 -37.03 71.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.226 -0.443 . . . . 74.41 110.881 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -61.87 -44.88 95.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 71.51 110.895 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp -76.94 -25.57 53.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.091 -0.504 . . . . 74.41 110.935 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -70.67 -177.46 1.55 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.43 . . . . 74.54 110.875 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 8.6 t 62.53 40.91 10.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.123 -0.489 . . . . 72.1 110.879 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 13.9 m -113.78 163.7 14.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.081 -0.509 . . . . 72.11 110.836 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 2.3 mt -58.94 134.07 24.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.112 -0.494 . . . . 75.15 111.137 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -179.43 165.18 1.38 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.162 -0.472 . . . . 74.14 110.846 179.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 44.6 mm -132.29 112.33 19.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 73.44 111.151 179.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 166.57 96.61 0.11 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.729 -0.748 . . . . 71.41 112.495 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 5.3 p-10 -85.61 147.99 26.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.857 0.361 . . . . 75.12 110.858 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -177.46 52.36 0.1 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.731 -0.747 . . . . 75.23 112.512 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -115.63 167.35 10.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.823 0.344 . . . . 73.21 110.872 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -168.64 -156.85 10.77 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.72 -0.752 . . . . 64.1 112.488 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 73.2 mm-40 -82.37 154.94 24.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.791 0.329 . . . . 73.43 110.917 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.3 p -83.52 -68.56 0.7 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.205 -0.452 . . . . 64.44 110.841 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -143.7 155.91 44.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 74.33 110.924 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 115' ' ' GLY . . . . . 0.455 ' O ' ' C ' ' A' ' 116' ' ' LEU . . . -112.36 -19.92 6.87 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.698 -0.763 . . . . 64.3 112.487 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 116' ' ' LEU . . . . . 0.455 ' C ' ' O ' ' A' ' 115' ' ' GLY . 0.4 OUTLIER 33.01 49.87 0.2 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.784 0.326 . . . . 73.52 110.957 -179.88 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 64.34 110.857 179.959 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 N-CA-C 112.498 -0.241 . . . . 75.01 112.498 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 1.4 mppp? -120.02 -32.32 4.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.796 0.331 . . . . 74.01 110.902 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -75.94 -74.89 0.2 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 74.02 110.886 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 3.9 mp 51.67 82.02 0.25 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.579 0.704 . . . . 71.25 111.163 179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.71 117.88 5.35 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.649 2.232 . . . . 74.14 112.388 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 30.5 t -107.02 5.06 27.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.246 -0.433 . . . . 74.34 110.84 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 2.0 mpp_? -51.62 162.72 0.69 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.567 0.698 . . . . 75.12 110.888 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 -11.19 30.31 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.642 2.228 . . . . 73.02 112.32 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 63.82 82.3 0.21 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.611 0.719 . . . . 73.31 111.083 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 141.18 44.47 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.663 2.242 . . . . 73.24 112.332 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 22.1 mtmm -86.81 159.61 51.66 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.578 0.704 . . . . 71.45 110.89 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 166.9 26.04 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.658 2.239 . . . . 74.43 112.383 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 99.53 0.75 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.696 2.264 . . . . 73.45 112.343 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 2.0 m -93.03 166.59 12.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 65.24 110.819 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 32.8 p -159.13 138.56 11.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 73.22 110.856 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 73.25 111.081 179.891 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.738 HD11 HG13 ' A' ' 28' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.805 0.336 . . . . 74.150000000000006 110.926 . . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.475 ' CE1' HD11 ' A' ' 60' ' ' LEU . 20.5 m-85 -133.22 146.11 51.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 73.409999999999997 110.949 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -122.56 153.47 39.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.187 -0.46 . . . . 61.0 111.103 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 24' ' ' GLU . 7.5 p -123.27 130.22 74.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.21 -0.45 . . . . 65.310000000000002 111.118 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.58 HG21 ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -72.26 138.17 47.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 52.229999999999997 111.182 -179.98 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.725 HD11 ' HB2' ' A' ' 56' ' ' ARG . 13.4 mt -112.44 -12.02 13.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.254 -0.43 . . . . 74.230000000000004 110.95 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -137.69 154.81 49.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.185 -0.461 . . . . 74.230000000000004 110.931 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -81.94 104.73 12.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.127 -0.488 . . . . 71.409999999999997 110.893 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -109.61 102.87 11.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 73.310000000000002 110.845 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -78.99 136.32 37.18 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 70.120000000000005 110.88 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.32 161.2 11.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 63.130000000000003 111.102 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -124.6 -36.47 2.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 44.119999999999997 110.936 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -132.45 -177.88 4.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 74.319999999999993 110.886 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -65.67 -15.12 62.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.221 -0.445 . . . . 74.0 110.886 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -99.03 22.34 10.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 64.430000000000007 110.878 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.0 mp0 -136.87 142.85 42.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 73.349999999999994 110.843 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.5 tp -121.36 126.45 49.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.145 -0.48 . . . . 61.439999999999998 110.946 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -65.5 139.96 58.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.457 . . . . 73.439999999999998 110.83 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.58 ' HB ' HG21 ' A' ' 6' ' ' THR . 0.4 OUTLIER -142.47 158.44 19.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 63.409999999999997 111.17 179.965 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -127.17 159.85 62.87 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.649 0.738 . . . . 61.310000000000002 110.83 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 117.78 5.29 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.659 2.239 . . . . 72.239999999999995 112.373 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.5 7.12 30.47 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.718 -0.753 . . . . 44.450000000000003 112.448 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.557 ' O ' HG23 ' A' ' 5' ' ' VAL . 22.2 mm-40 -91.91 162.49 14.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.857 0.36 . . . . 74.129999999999995 110.908 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -107.96 119.42 39.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 74.040000000000006 110.897 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.778 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 5.5 mt -120.98 154.29 36.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.195 -0.457 . . . . 73.25 110.946 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -109.03 115.94 31.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 65.329999999999998 110.844 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.738 HG13 HD11 ' A' ' 2' ' ' LEU . 35.4 mm -70.57 143.32 14.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.476 . . . . 53.530000000000001 111.149 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.9 m -124.5 -37.13 2.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 71.230000000000004 110.887 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -168.87 170.62 9.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 40.539999999999999 111.093 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -123.89 174.51 7.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 73.340000000000003 110.873 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -142.16 100.68 3.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 75.239999999999995 110.896 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 60.09 18.78 8.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.075 -0.511 . . . . 63.439999999999998 110.87 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.616 ' HD2' HD12 ' A' ' 81' ' ' ILE . 36.4 m-85 65.45 23.95 11.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.218 -0.446 . . . . 75.150000000000006 110.942 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.492 ' O ' HG23 ' A' ' 52' ' ' VAL . 0.4 OUTLIER -116.92 -41.31 3.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.098 -0.501 . . . . 74.299999999999997 110.866 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.426 ' CD1' ' HB2' ' A' ' 35' ' ' GLU . 56.6 m95 -116.62 140.32 49.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.185 -0.461 . . . . 74.439999999999998 110.926 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.613 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -119.31 142.8 47.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 52.130000000000003 110.873 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 23.5 mm -96.27 95.44 4.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 71.549999999999997 111.103 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.778 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -109.06 136.38 48.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 60.409999999999997 111.099 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.8 pttt -111.46 157.73 38.31 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.621 0.724 . . . . 74.230000000000004 110.908 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 135.53 30.58 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.701 2.268 . . . . 64.409999999999997 112.367 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 79.3 mt . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.26 -0.427 . . . . 75.519999999999996 111.152 179.923 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo . . . . . 0 N--CA 1.466 -0.133 0 CA-C-O 120.806 0.253 . . . . 73.299999999999997 112.327 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.22 -143.29 4.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.771 -0.728 . . . . 54.140000000000001 112.504 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.412 HD11 ' HD3' ' B' ' -5' ' ' PRO . 0.2 OUTLIER -146.17 124.86 12.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.893 0.378 . . . . 61.100000000000001 110.899 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.442 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.3 p -136.18 133.87 19.82 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.635 0.731 . . . . 74.219999999999999 111.14 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.442 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.8 Cg_endo -69.76 153.18 69.22 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.664 2.243 . . . . 72.239999999999995 112.352 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.782 HG12 ' HB ' ' A' ' 71' ' ' THR . 11.1 t -66.34 -21.74 29.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.245 -0.434 . . . . 72.219999999999999 111.164 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.1 m -77.94 -1.93 34.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.154 -0.475 . . . . 72.310000000000002 110.871 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -126.84 22.91 6.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.137 -0.483 . . . . 73.109999999999999 110.934 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.559 HG22 ' HA ' ' A' ' 52' ' ' VAL . 16.8 m -150.23 165.18 3.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.1 -0.5 . . . . 74.510000000000005 111.181 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.725 ' HB2' HD11 ' A' ' 7' ' ' LEU . 40.0 ttp85 -133.5 114.02 13.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.233 -0.44 . . . . 74.510000000000005 110.865 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 29.1 mm -69.37 127.34 31.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 74.319999999999993 111.129 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.444 HG21 ' NH1' ' A' ' 56' ' ' ARG . 24.7 pt -143.49 -178.22 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 73.409999999999997 111.132 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -131.44 132.67 44.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.467 . . . . 62.119999999999997 110.838 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.475 HD11 ' CE1' ' A' ' 3' ' ' PHE . 57.6 mt -59.28 -21.84 60.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 73.430000000000007 110.974 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.1 mtm -90.04 -30.21 17.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.14 -0.482 . . . . 74.219999999999999 110.903 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -152.19 75.69 7.27 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.584 0.707 . . . . 74.450000000000003 110.855 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.713 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.3 Cg_endo -69.82 -11.12 30.11 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.64 2.226 . . . . 74.099999999999994 112.308 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.07 -5.56 47.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.241 -0.436 . . . . 65.219999999999999 111.107 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.3 ttmm -83.06 -51.12 7.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 63.109999999999999 110.916 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.614 ' O ' HG12 ' A' ' 69' ' ' VAL . 88.6 m-85 -99.76 23.23 9.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.232 -0.44 . . . . 64.340000000000003 110.921 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.713 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -87.03 -20.88 26.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.484 . . . . 65.439999999999998 111.118 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.0 t -92.85 -21.06 20.09 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.2 -0.455 . . . . 72.430000000000007 110.865 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 1.052 HG21 HD11 ' A' ' 80' ' ' ILE . 7.6 p -51.55 152.27 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.495 . . . . 72.340000000000003 111.151 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -104.18 91.33 3.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 42.25 110.903 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.782 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -51.6 -35.66 42.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 73.329999999999998 111.136 -179.864 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -58.02 -43.98 87.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.221 -0.445 . . . . 72.0 110.969 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -63.83 107.98 1.35 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.094 -0.503 . . . . 61.009999999999998 110.846 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.28 -28.46 19.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 75.540000000000006 110.851 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -66.73 -55.0 17.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 63.240000000000002 110.896 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -59.58 -56.35 23.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 74.209999999999994 110.891 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.401 HG21 HG11 ' A' ' 52' ' ' VAL . 4.2 p -53.44 -32.34 20.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 74.409999999999997 111.152 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 9.8 mtm -67.41 -54.51 19.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 61.119999999999997 110.879 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.83 -37.91 69.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.263 -0.426 . . . . 71.099999999999994 110.863 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 1.052 HD11 HG21 ' A' ' 69' ' ' VAL . 84.4 mt -66.12 -53.46 36.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 71.129999999999995 111.155 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.76 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.4 mt -61.86 -36.21 72.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.459 . . . . 73.230000000000004 111.124 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 61.1 t0 -71.05 -48.26 53.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 51.299999999999997 110.864 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -60.88 -53.89 51.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 73.439999999999998 110.896 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -69.21 -11.96 61.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.475 . . . . 70.310000000000002 110.9 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt 58.45 54.53 5.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 72.430000000000007 110.872 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.76 ' HB ' HG23 ' A' ' 81' ' ' ILE . 20.5 mt -81.06 131.61 59.08 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.638 0.733 . . . . 72.450000000000003 111.094 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 159.04 54.84 Favored 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.675 2.25 . . . . 64.049999999999997 112.384 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -92.84 170.0 10.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 73.010000000000005 111.188 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.692 HG11 ' O ' ' B' ' -7' ' ' PHE . 98.4 t -52.04 -58.07 2.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.28 -0.418 . . . . 65.239999999999995 111.074 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -51.54 -51.86 51.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.451 . . . . 64.109999999999999 110.881 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 51.5 mm-40 -57.23 -38.56 73.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.136 -0.484 . . . . 64.409999999999997 110.971 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 24.2 t90 -66.39 -43.3 86.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.169 -0.469 . . . . 63.299999999999997 110.929 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -61.54 -47.92 83.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 44.409999999999997 110.927 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -64.69 -39.93 94.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.436 . . . . 73.230000000000004 110.886 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -60.39 -49.24 78.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.454 . . . . 74.430000000000007 110.94 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.444 . . . . 75.040000000000006 111.121 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' -7' ' ' PHE . . . . . 0.692 ' O ' HG11 ' A' ' 89' ' ' VAL . 38.8 m-85 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.893 0.378 . . . . 53.030000000000001 110.891 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 26.7 mm -110.82 81.64 2.65 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.631 0.729 . . . . 71.530000000000001 111.087 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' -5' ' ' PRO . . . . . 0.412 ' HD3' HD11 ' A' ' 49' ' ' LEU . 54.2 Cg_endo -69.74 78.46 1.0 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.667 2.245 . . . . 74.420000000000002 112.333 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 29.7 m -82.5 0.31 43.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.254 -0.43 . . . . 71.030000000000001 110.857 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 2.1 mpp_? -67.63 162.17 59.57 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.552 0.692 . . . . 64.140000000000001 110.864 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 158.88 55.48 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.651 2.234 . . . . 55.450000000000003 112.411 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -91.37 111.94 51.51 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.55 0.69 . . . . 72.120000000000005 111.101 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 149.84 67.23 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.65 2.233 . . . . 70.010000000000005 112.355 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 17.0 mtmt -99.89 161.18 25.18 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.598 0.713 . . . . 73.209999999999994 110.913 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 168.25 22.07 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.7 2.267 . . . . 55.109999999999999 112.336 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--N 1.341 0.181 0 C-N-CA 122.627 2.218 . . . . 71.140000000000001 112.368 179.962 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.43 HD12 HG23 ' A' ' 57' ' ' ILE . 1.3 pt? . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.813 0.34 . . . . 75.219999999999999 110.917 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.72 ' CD1' HD23 ' A' ' 60' ' ' LEU . 63.8 m-85 -115.26 153.68 30.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.178 -0.464 . . . . 62.399999999999999 110.892 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -129.47 152.88 48.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 72.030000000000001 111.14 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.453 HG13 ' HB3' ' A' ' 56' ' ' ARG . 6.1 p -120.49 125.65 74.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.261 -0.427 . . . . 51.100000000000001 111.127 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.725 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -66.95 131.39 45.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 75.049999999999997 111.105 -179.936 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.616 HD11 ' HB2' ' A' ' 56' ' ' ARG . 71.3 mt -102.36 -17.87 15.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 75.439999999999998 110.918 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -133.96 157.14 46.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 75.540000000000006 110.963 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -82.55 105.28 13.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 74.209999999999994 110.878 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -84.64 105.05 15.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.117 -0.492 . . . . 72.219999999999999 110.88 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.5 mttp -81.22 97.82 7.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 74.140000000000001 110.871 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.36 140.35 22.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 54.509999999999998 111.106 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -107.06 -28.86 9.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 63.340000000000003 110.89 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -129.77 -179.25 5.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.466 . . . . 70.439999999999998 110.868 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -65.02 -36.9 85.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 70.209999999999994 110.859 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -63.25 -34.91 78.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.167 -0.47 . . . . 70.140000000000001 110.88 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -77.16 140.7 40.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.179 -0.464 . . . . 72.129999999999995 110.922 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 12.3 tp -112.54 127.2 56.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.155 -0.475 . . . . 74.049999999999997 110.937 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 -72.89 125.22 27.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.247 -0.433 . . . . 74.319999999999993 110.838 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.725 ' CG1' HG21 ' A' ' 6' ' ' THR . 10.1 p -138.78 152.65 24.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 74.230000000000004 111.106 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -114.41 159.64 35.98 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.673 0.749 . . . . 74.340000000000003 110.859 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 123.18 9.83 Favored 'Trans proline' 0 C--N 1.341 0.143 0 C-N-CA 122.672 2.248 . . . . 73.129999999999995 112.346 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.09 4.53 31.12 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.696 -0.764 . . . . 60.439999999999998 112.47 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.407 ' O ' HG23 ' A' ' 5' ' ' VAL . 23.3 mm-40 -92.01 165.1 13.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.842 0.353 . . . . 72.150000000000006 110.91 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.654 ' HB3' HD12 ' A' ' 42' ' ' ILE . 7.9 m120 -110.75 128.37 55.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.151 -0.477 . . . . 72.219999999999999 110.915 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.74 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 2.1 mt -128.24 146.48 50.72 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.188 -0.46 . . . . 71.420000000000002 110.902 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.25 123.26 39.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 74.219999999999999 110.891 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 34.3 mm -70.12 144.49 13.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.468 . . . . 63.420000000000002 111.146 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 21.8 m -125.77 -37.48 2.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 74.329999999999998 110.879 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -179.11 171.54 1.34 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 41.539999999999999 111.121 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.549 ' O ' HG22 ' A' ' 88' ' ' THR . 2.7 p80 -124.25 176.85 6.16 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 71.439999999999998 110.876 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.402 ' HB3' ' HB2' ' A' ' 36' ' ' TRP . 29.5 t80 -148.03 102.78 3.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 73.310000000000002 110.942 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 60.16 18.64 8.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.139 -0.482 . . . . 74.540000000000006 110.883 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.605 ' HD2' HD12 ' A' ' 81' ' ' ILE . 44.2 m-85 61.79 20.23 11.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 75.299999999999997 110.922 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -119.47 -3.81 10.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.113 -0.494 . . . . 64.400000000000006 110.863 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.512 ' HB3' HD21 ' A' ' 49' ' ' LEU . 90.5 m95 -151.57 135.8 16.74 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.148 -0.478 . . . . 75.010000000000005 110.893 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.6 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -120.06 145.64 46.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.231 -0.44 . . . . 70.439999999999998 110.887 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.8 mm -100.83 95.12 3.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.122 -0.49 . . . . 75.140000000000001 111.119 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.74 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.18 134.91 51.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.469 . . . . 71.340000000000003 111.107 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.8 pttt -111.34 156.75 40.68 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.59 0.71 . . . . 73.200000000000003 110.885 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 115.44 4.1 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.722 2.281 . . . . 73.540000000000006 112.313 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.654 HD12 ' HB3' ' A' ' 25' ' ' ASN . 55.1 mt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 52.399999999999999 111.142 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--O 1.23 0.083 0 CA-C-O 120.825 0.26 . . . . 64.140000000000001 112.31 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -133.68 -156.8 8.09 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.744 -0.741 . . . . 41.229999999999997 112.496 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.512 HD21 ' HB3' ' A' ' 36' ' ' TRP . 1.7 tt -131.11 124.86 31.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.797 0.332 . . . . 61.350000000000001 110.953 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.442 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.3 p -137.23 133.46 18.37 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.613 0.72 . . . . 72.450000000000003 111.13 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.442 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.7 Cg_endo -69.75 155.63 65.46 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.644 2.23 . . . . 63.100000000000001 112.341 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.801 HG12 ' HB ' ' A' ' 71' ' ' THR . 9.4 t -68.39 -21.44 26.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.45 . . . . 74.430000000000007 111.134 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -77.24 -3.06 37.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.152 -0.476 . . . . 63.229999999999997 110.837 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -124.89 19.91 8.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.131 -0.486 . . . . 73.150000000000006 110.882 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.571 HG22 ' HA ' ' A' ' 52' ' ' VAL . 17.0 m -150.24 157.41 6.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.111 -0.495 . . . . 54.100000000000001 111.094 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.616 ' HB2' HD11 ' A' ' 7' ' ' LEU . 22.4 ttp180 -123.93 110.77 15.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 72.109999999999999 110.853 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.502 HG21 HG21 ' A' ' 80' ' ' ILE . 38.9 mm -64.69 121.37 13.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 60.409999999999997 111.135 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.423 HG23 ' HG2' ' A' ' 56' ' ' ARG . 14.8 pt -136.18 173.41 13.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.172 -0.467 . . . . 73.120000000000005 111.16 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -115.92 126.33 53.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 74.510000000000005 110.839 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.72 HD23 ' CD1' ' A' ' 3' ' ' PHE . 0.2 OUTLIER -52.49 -29.34 24.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 74.310000000000002 110.95 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.82 -26.01 19.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.216 -0.447 . . . . 73.420000000000002 110.9 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -141.61 73.76 23.91 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.611 0.72 . . . . 74.430000000000007 110.878 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.594 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 54.0 Cg_endo -69.77 -8.97 24.97 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.691 2.26 . . . . 72.219999999999999 112.387 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -102.67 -17.61 15.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 74.329999999999998 111.116 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.9 ttmm -73.44 -51.9 15.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 73.109999999999999 110.918 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.557 ' O ' HG12 ' A' ' 69' ' ' VAL . 81.5 m-85 -95.43 23.03 6.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 75.120000000000005 110.948 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.594 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -86.99 -19.96 27.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.118 -0.492 . . . . 73.219999999999999 111.075 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 8.2 p -88.67 -19.92 25.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 50.340000000000003 110.822 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 1.062 HG21 HD11 ' A' ' 80' ' ' ILE . 7.0 p -51.53 148.28 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 70.409999999999997 111.125 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -105.82 89.44 3.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 75.150000000000006 110.862 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.801 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.5 OUTLIER -51.32 -30.38 18.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 62.509999999999998 111.169 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -61.25 -48.5 81.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.187 -0.46 . . . . 65.010000000000005 110.909 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.85 112.57 2.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.159 -0.473 . . . . 75.109999999999999 110.877 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.42 -24.64 31.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.155 -0.475 . . . . 54.539999999999999 110.887 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -66.9 -54.01 26.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 74.439999999999998 110.885 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -59.83 -57.89 10.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 73.450000000000003 110.876 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.622 HG21 HG11 ' A' ' 52' ' ' VAL . 2.0 p -51.88 -32.21 14.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 74.519999999999996 111.144 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 9.9 mtm -68.11 -53.22 26.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 65.310000000000002 110.855 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.9 mttm -55.75 -38.14 69.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 60.109999999999999 110.884 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 1.062 HD11 HG21 ' A' ' 69' ' ' VAL . 30.0 mt -66.65 -55.63 17.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 63.229999999999997 111.154 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.773 HG23 ' HB ' ' A' ' 86' ' ' ILE . 93.0 mt -59.98 -36.78 69.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 51.310000000000002 111.137 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -71.22 -52.08 21.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 40.409999999999997 110.854 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -60.21 -51.16 70.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.161 -0.472 . . . . 72.519999999999996 110.876 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -70.03 -11.16 60.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 55.229999999999997 110.86 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 26.9 mmtt 58.12 49.19 11.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 74.099999999999994 110.856 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.773 ' HB ' HG23 ' A' ' 81' ' ' ILE . 14.2 mt -78.28 125.74 84.43 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.607 0.718 . . . . 70.040000000000006 111.13 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 158.3 57.43 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.682 2.255 . . . . 64.010000000000005 112.325 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.549 HG22 ' O ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -87.41 172.23 9.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 62.210000000000001 111.149 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.9 t -52.28 -51.69 30.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 74.010000000000005 111.111 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -51.6 -51.97 51.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 71.219999999999999 110.859 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 43.0 mm-40 -58.13 -40.77 82.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 72.400000000000006 110.956 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 23.6 t90 -64.89 -40.5 95.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 73.329999999999998 110.945 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.69 -52.45 60.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.233 -0.439 . . . . 71.0 110.88 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -59.18 -43.97 92.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 74.129999999999995 110.849 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -59.38 -48.81 80.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.462 . . . . 72.340000000000003 110.873 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.2 p . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.23 -0.441 . . . . 54.299999999999997 111.142 -179.905 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' -7' ' ' PHE . . . . . 0.501 ' HB3' HD12 ' A' ' 49' ' ' LEU . 66.9 m-85 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.781 0.324 . . . . 74.450000000000003 110.887 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.3 mm 51.81 77.08 0.48 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.57 0.7 . . . . 74.510000000000005 111.127 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 92.36 0.51 Allowed 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.654 2.236 . . . . 74.150000000000006 112.368 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 29.1 t -89.44 3.54 51.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 45.009999999999998 110.861 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.47 162.17 0.72 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.623 0.725 . . . . 74.019999999999996 110.861 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -16.16 37.65 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.653 2.236 . . . . 53.229999999999997 112.354 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.3 80.56 0.23 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.617 0.723 . . . . 70.409999999999997 111.113 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 154.1 68.1 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.691 2.261 . . . . 52.100000000000001 112.335 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -93.51 159.54 34.81 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.555 0.693 . . . . 64.209999999999994 110.87 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 166.8 26.41 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.685 2.256 . . . . 75.200000000000003 112.315 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo . . . . . 0 C--N 1.341 0.156 0 C-N-CA 122.731 2.287 . . . . 60.240000000000002 112.332 179.938 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.583 ' CD1' HD12 ' A' ' 28' ' ' ILE . 1.4 pp . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.817 0.341 . . . . 53.039999999999999 110.938 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.608 ' CE1' HD12 ' A' ' 60' ' ' LEU . 19.0 m-85 -118.49 152.05 36.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.2 -0.454 . . . . 70.109999999999999 110.869 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 1.049 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -120.06 163.14 18.1 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 73.150000000000006 111.13 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.416 ' O ' HG13 ' A' ' 5' ' ' VAL . 5.6 p -133.75 119.26 32.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 74.319999999999993 111.132 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.732 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -67.14 139.19 57.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.461 . . . . 73.120000000000005 111.127 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.0 mt -106.02 -18.37 14.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.265 -0.425 . . . . 61.009999999999998 110.941 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -139.06 163.9 31.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.168 -0.469 . . . . 71.120000000000005 110.945 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -80.44 113.45 18.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.114 -0.494 . . . . 73.109999999999999 110.908 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -98.17 111.57 23.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.217 -0.447 . . . . 74.319999999999993 110.853 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.05 121.01 26.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.491 . . . . 73.420000000000002 110.906 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.446 ' HB1' ' HB3' ' A' ' 17' ' ' GLU . . . -74.93 156.53 36.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 54.119999999999997 111.126 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -124.18 -37.69 2.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.257 -0.429 . . . . 63.140000000000001 110.891 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.7 mmt180 -128.85 178.92 6.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.179 -0.464 . . . . 71.340000000000003 110.87 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -55.84 -44.54 78.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.2 -0.455 . . . . 74.140000000000001 110.872 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -54.54 -51.91 63.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 75.510000000000005 110.883 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.446 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 0.1 OUTLIER -60.55 147.94 39.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 74.049999999999997 110.858 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.3 tp -128.82 120.81 26.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.168 -0.469 . . . . 72.099999999999994 110.951 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -66.47 137.46 56.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.461 . . . . 75.230000000000004 110.859 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.732 ' CG1' HG21 ' A' ' 6' ' ' THR . 7.2 p -153.15 146.07 14.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 72.430000000000007 111.09 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.6 m -103.42 160.47 26.04 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 121.735 0.779 . . . . 71.420000000000002 110.825 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 118.36 5.64 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.685 2.257 . . . . 73.25 112.334 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.02 5.02 31.08 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.717 -0.754 . . . . 72.329999999999998 112.499 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -92.18 156.87 17.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.893 0.378 . . . . 73.420000000000002 110.899 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.498 ' CB ' HD12 ' A' ' 42' ' ' ILE . 4.7 m120 -104.45 133.76 48.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.152 -0.476 . . . . 72.010000000000005 110.864 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.544 HD11 HG21 ' A' ' 20' ' ' VAL . 4.4 mp -133.82 149.47 51.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.475 . . . . 73.329999999999998 110.929 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.8 t -100.86 112.59 25.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 53.229999999999997 110.869 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 1.049 HD11 ' HB2' ' A' ' 4' ' ' ALA . 57.5 mt -77.02 150.83 5.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.133 -0.485 . . . . 73.109999999999999 111.15 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 34.0 m -125.85 -36.69 2.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 74.0 110.858 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.0 179.2 9.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.456 . . . . 55.329999999999998 111.069 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.712 ' O ' HG23 ' A' ' 89' ' ' VAL . 1.5 p80 -132.82 178.21 7.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 71.25 110.806 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -137.8 99.09 3.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.167 -0.47 . . . . 72.439999999999998 110.947 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.9 t70 53.07 26.54 4.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.469 . . . . 71.409999999999997 110.862 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.592 ' HD2' HD12 ' A' ' 81' ' ' ILE . 23.4 m-85 62.85 26.06 15.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 64.420000000000002 110.903 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.433 ' O ' HG23 ' A' ' 52' ' ' VAL . 12.2 mm-40 -114.48 -40.27 3.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.13 -0.487 . . . . 74.25 110.894 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -122.3 155.48 35.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.12 -0.491 . . . . 73.409999999999997 110.95 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.759 ' CD2' HG22 ' A' ' 52' ' ' VAL . 2.4 m-85 -128.19 130.83 48.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 64.450000000000003 110.855 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 48' ' ' GLY . 19.0 mm -91.33 94.12 4.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 64.340000000000003 111.128 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -116.23 157.07 25.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 70.329999999999998 111.116 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.3 pttp -123.25 156.84 62.8 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.564 0.697 . . . . 74.310000000000002 110.9 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 127.85 15.2 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.664 2.243 . . . . 74.409999999999997 112.401 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.498 HD12 ' CB ' ' A' ' 25' ' ' ASN . 60.1 mt . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 72.510000000000005 111.11 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo . . . . . 0 C--O 1.231 0.153 0 CA-C-O 120.805 0.252 . . . . 54.32 112.373 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.663 ' O ' HG23 ' A' ' 38' ' ' ILE . . . -136.83 -120.51 1.95 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.713 -0.756 . . . . 54.409999999999997 112.443 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -159.45 125.9 4.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.832 0.348 . . . . 73.340000000000003 110.891 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.694 HG21 HG21 ' A' ' 55' ' ' VAL . 3.0 m -136.47 138.88 27.94 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.606 0.717 . . . . 65.530000000000001 111.134 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 130.01 18.57 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.664 2.243 . . . . 70.120000000000005 112.369 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.759 HG22 ' CD2' ' A' ' 37' ' ' PHE . 22.1 t -57.35 -21.69 15.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 71.239999999999995 111.132 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.4 p -74.34 -6.26 47.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 53.329999999999998 110.888 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -119.52 -25.27 6.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.101 -0.5 . . . . 72.519999999999996 110.893 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.868 HG13 ' HB1' ' A' ' 4' ' ' ALA . 1.3 t -106.16 138.69 30.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 73.299999999999997 111.105 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.8 ttp180 -111.2 123.64 50.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 64.219999999999999 110.855 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.739 HD11 ' CE2' ' A' ' 37' ' ' PHE . 24.2 mm -70.79 128.88 34.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 74.450000000000003 111.141 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 16.0 pt -145.69 174.12 3.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 61.109999999999999 111.129 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -117.84 130.19 56.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.186 -0.461 . . . . 74.439999999999998 110.872 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.608 HD12 ' CE1' ' A' ' 3' ' ' PHE . 3.8 mt -58.04 -22.73 51.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 71.239999999999995 110.895 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.4 mmt -89.54 -27.93 19.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 73.530000000000001 110.899 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -152.58 75.84 6.95 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.659 0.743 . . . . 73.5 110.857 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.738 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.9 Cg_endo -69.78 -8.52 23.82 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.676 2.251 . . . . 63.119999999999997 112.313 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.34 -15.33 24.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 71.530000000000001 111.128 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -76.16 -52.04 10.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 72.25 110.878 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.611 ' O ' HG12 ' A' ' 69' ' ' VAL . 57.6 m-85 -96.21 23.46 6.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 75.299999999999997 110.894 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.738 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -87.58 -18.02 30.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 52.43 111.08 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.0 p -89.96 -23.79 21.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 71.200000000000003 110.853 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.611 HG12 ' O ' ' A' ' 66' ' ' TYR . 8.2 p -53.32 139.17 11.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.129 -0.487 . . . . 74.530000000000001 111.097 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -94.32 91.38 6.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 74.420000000000002 110.893 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.747 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -51.3 -30.23 17.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.178 -0.465 . . . . 74.319999999999993 111.127 -179.866 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -58.95 -48.1 82.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 71.140000000000001 110.927 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -64.03 111.08 2.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.138 -0.483 . . . . 62.340000000000003 110.851 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.59 -24.76 34.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 74.430000000000007 110.874 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -66.79 -55.25 15.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.461 . . . . 65.239999999999995 110.907 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.52 ' O ' HD12 ' A' ' 80' ' ' ILE . 0.6 OUTLIER -58.77 -58.32 9.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.129 -0.487 . . . . 70.430000000000007 110.909 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 1.8 p -51.45 -31.46 12.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 75.400000000000006 111.091 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.7 mtm -68.49 -51.58 41.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 73.230000000000004 110.879 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 32.8 mttt -56.36 -43.77 79.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.466 . . . . 75.120000000000005 110.9 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.52 HD12 ' O ' ' A' ' 76' ' ' GLN . 1.7 mp -63.62 -56.05 19.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 65.349999999999994 111.116 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.646 HG23 ' HB ' ' A' ' 86' ' ' ILE . 85.2 mt -55.88 -37.16 46.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.465 . . . . 75.439999999999998 111.145 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -71.23 -51.99 21.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 72.540000000000006 110.829 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -58.5 -51.21 70.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 61.409999999999997 110.906 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -67.8 -14.77 63.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 64.099999999999994 110.883 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.5 mmtt 61.09 52.83 3.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.095 -0.502 . . . . 75.219999999999999 110.931 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.646 ' HB ' HG23 ' A' ' 81' ' ' ILE . 37.3 mt -81.5 131.9 56.92 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.637 0.732 . . . . 74.430000000000007 111.103 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 153.45 68.74 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.659 2.24 . . . . 73.140000000000001 112.331 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.63 165.96 13.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 73.239999999999995 111.139 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.712 HG23 ' O ' ' A' ' 31' ' ' HIS . 86.1 t -51.24 -58.09 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 65.439999999999998 111.149 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -50.81 -51.2 53.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.176 -0.465 . . . . 73.019999999999996 110.892 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 55.5 mm-40 -57.12 -41.6 79.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.479 . . . . 74.109999999999999 110.918 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 29.3 t90 -65.37 -36.96 85.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.201 -0.454 . . . . 74.530000000000001 110.936 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.3 mmpp? -65.75 -50.08 66.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 74.310000000000002 110.875 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.62 -44.86 96.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 75.109999999999999 110.844 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 40.5 mm-40 -60.22 -47.56 85.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 73.319999999999993 110.914 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 26.4 p . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.192 -0.458 . . . . 74.310000000000002 111.122 -179.892 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.839 0.352 . . . . 74.329999999999998 110.94 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 24.3 mm 51.07 74.29 0.83 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.633 0.73 . . . . 73.400000000000006 111.115 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 127.98 15.35 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.655 2.237 . . . . 65.340000000000003 112.322 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.89 12.11 9.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 62.329999999999998 110.86 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.69 162.43 0.74 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.595 0.712 . . . . 74.099999999999994 110.866 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -11.34 30.66 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.69 2.26 . . . . 71.349999999999994 112.369 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 57.79 80.93 0.26 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.59 0.709 . . . . 72.400000000000006 111.08 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 144.04 52.64 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.703 2.269 . . . . 73.019999999999996 112.326 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 38.8 mtmt -80.29 160.87 66.94 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.544 0.687 . . . . 73.409999999999997 110.906 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 165.68 30.1 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.666 2.244 . . . . 63.100000000000001 112.344 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 C--N 1.341 0.174 0 C-N-CA 122.708 2.272 . . . . 52.219999999999999 112.309 179.96 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.681 HD21 HD11 ' A' ' 86' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.867 0.365 . . . . 65.209999999999994 110.919 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.75 ' CZ ' HD12 ' A' ' 60' ' ' LEU . 81.0 m-85 -137.92 139.89 40.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 75.129999999999995 110.879 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.445 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -130.34 157.99 41.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.135 -0.484 . . . . 62.409999999999997 111.133 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 24' ' ' GLU . 8.5 p -124.13 128.5 74.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 71.0 111.149 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.682 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.2 OUTLIER -72.48 127.43 32.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 52.32 111.133 -179.934 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.3 mt -101.21 -18.66 16.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.204 -0.453 . . . . 63.020000000000003 110.913 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -133.78 161.56 34.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 62.450000000000003 110.898 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -82.02 105.49 13.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 65.519999999999996 110.876 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -87.28 125.46 34.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 61.43 110.879 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.43 104.39 14.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 71.040000000000006 110.874 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.678 ' HB1' ' HB2' ' A' ' 17' ' ' GLU . . . -53.53 160.37 1.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 64.239999999999995 111.094 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -118.47 -32.22 4.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 74.5 110.879 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -124.09 -175.79 3.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 62.210000000000001 110.821 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -67.07 -38.93 86.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.459 . . . . 64.120000000000005 110.852 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -59.65 -53.1 61.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.231 -0.44 . . . . 75.239999999999995 110.844 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.678 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 5.2 mm-40 -54.24 164.65 0.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.218 -0.446 . . . . 74.329999999999998 110.862 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.408 HD22 ' HD3' ' A' ' 41' ' ' PRO . 4.5 tp -139.46 142.8 37.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.489 . . . . 73.439999999999998 110.868 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -86.6 143.09 27.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.466 . . . . 71.230000000000004 110.848 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.682 ' CG1' HG21 ' A' ' 6' ' ' THR . 6.7 p -153.11 144.03 14.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.226 -0.443 . . . . 74.25 111.109 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.4 m -102.32 160.33 26.67 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.637 0.732 . . . . 42.020000000000003 110.873 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 126.38 13.26 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.652 2.235 . . . . 74.510000000000005 112.332 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.0 -0.21 31.64 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.737 -0.744 . . . . 74.530000000000001 112.508 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.409 ' O ' HG23 ' A' ' 5' ' ' VAL . 2.8 mm-40 -92.11 170.37 9.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.86 0.362 . . . . 74.5 110.86 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -116.26 130.06 56.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 74.299999999999997 110.852 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.763 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 3.1 mp -125.09 144.79 50.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.17 -0.468 . . . . 62.210000000000001 110.927 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -97.31 112.66 24.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 53.140000000000001 110.842 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.611 ' HB ' HD12 ' A' ' 2' ' ' LEU . 58.8 mt -78.86 141.52 15.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 74.230000000000004 111.108 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 55.3 m -119.33 -48.81 2.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 73.239999999999995 110.861 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.422 ' HA ' HG22 ' A' ' 86' ' ' ILE . . . -146.09 172.68 13.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 74.540000000000006 111.084 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.513 ' O ' HG23 ' A' ' 89' ' ' VAL . 1.3 p80 -128.06 178.25 6.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.242 -0.435 . . . . 70.319999999999993 110.829 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -138.77 99.88 3.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 75.150000000000006 110.933 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.1 t70 54.26 26.35 6.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.135 -0.484 . . . . 60.210000000000001 110.839 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.593 ' HD2' HD12 ' A' ' 81' ' ' ILE . 38.4 m-85 63.08 25.37 14.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.204 -0.453 . . . . 73.219999999999999 110.933 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.488 ' O ' HG23 ' A' ' 52' ' ' VAL . 14.7 mm-40 -114.11 -50.01 2.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 74.439999999999998 110.858 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.531 ' HB3' HD21 ' A' ' 49' ' ' LEU . 67.9 m95 -111.42 143.97 41.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.167 -0.47 . . . . 73.109999999999999 110.9 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.679 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -119.69 133.5 55.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.442 . . . . 74.329999999999998 110.918 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.8 mm -88.79 95.23 5.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 72.310000000000002 111.145 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.763 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.6 142.7 42.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.205 -0.452 . . . . 75.329999999999998 111.105 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.52 153.63 46.65 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.558 0.694 . . . . 72.010000000000005 110.889 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.408 ' HD3' HD22 ' A' ' 18' ' ' LEU . 53.6 Cg_endo -69.79 105.89 1.57 Allowed 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.683 2.255 . . . . 64.049999999999997 112.369 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.7 mt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.242 -0.435 . . . . 73.430000000000007 111.107 179.976 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo . . . . . 0 N--CA 1.466 -0.141 0 CA-C-O 120.83 0.263 . . . . 74.310000000000002 112.325 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -127.7 -137.1 4.39 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.754 -0.736 . . . . 53.340000000000003 112.468 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.531 HD21 ' HB3' ' A' ' 36' ' ' TRP . 1.2 tt -149.55 125.84 10.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.861 0.362 . . . . 54.43 110.908 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 12.4 p -136.58 132.7 18.77 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.622 0.725 . . . . 62.229999999999997 111.096 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.593 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.6 Cg_endo -69.78 151.53 68.97 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.707 2.272 . . . . 64.430000000000007 112.287 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.771 HG12 ' HB ' ' A' ' 71' ' ' THR . 14.2 t -62.9 -21.9 29.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.232 -0.44 . . . . 72.409999999999997 111.155 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.1 m -78.4 -2.4 38.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 61.340000000000003 110.877 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -125.07 17.58 8.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 74.219999999999999 110.907 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.593 HG22 ' O ' ' A' ' 51' ' ' PRO . 5.2 m -153.56 153.1 9.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 73.140000000000001 111.127 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.53 ' HG2' HG23 ' A' ' 58' ' ' ILE . 18.5 ttm180 -123.75 119.84 30.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.151 -0.477 . . . . 71.209999999999994 110.915 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 16.1 mm -67.19 113.81 3.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 75.549999999999997 111.168 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.53 HG23 ' HG2' ' A' ' 56' ' ' ARG . 1.2 pt -135.33 139.07 47.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 61.329999999999998 111.126 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -75.27 122.07 23.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 71.019999999999996 110.878 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.75 HD12 ' CZ ' ' A' ' 3' ' ' PHE . 0.6 OUTLIER -51.98 -31.7 30.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.213 -0.449 . . . . 73.439999999999998 110.876 -179.912 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -85.56 -28.52 24.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 74.040000000000006 110.869 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -143.96 77.53 14.61 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.638 0.732 . . . . 63.240000000000002 110.896 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.737 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.6 Cg_endo -69.78 -8.17 22.92 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.675 2.25 . . . . 75.120000000000005 112.367 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.91 -5.69 44.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 70.129999999999995 111.125 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -84.04 -51.75 6.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 72.099999999999994 110.904 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.615 ' O ' HG12 ' A' ' 69' ' ' VAL . 12.2 m-85 -99.87 23.62 9.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 74.209999999999994 110.931 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.737 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -83.37 -15.93 47.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.122 -0.49 . . . . 62.32 111.112 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 8.9 m -98.14 -18.74 18.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.439999999999998 110.894 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 1.026 HG21 HD11 ' A' ' 80' ' ' ILE . 9.3 p -51.14 150.22 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.092 -0.504 . . . . 74.099999999999994 111.129 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -104.76 88.5 2.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 74.120000000000005 110.84 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.771 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -51.89 -43.22 63.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.219 -0.446 . . . . 63.329999999999998 111.089 -179.857 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -53.67 -43.89 69.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.282 -0.417 . . . . 74.099999999999994 110.92 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -63.92 110.15 2.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 71.109999999999999 110.864 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.23 -26.33 28.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 72.010000000000005 110.857 -179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -67.11 -56.07 11.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 71.010000000000005 110.893 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -59.2 -56.65 19.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.479 . . . . 73.340000000000003 110.902 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.414 HG21 HG11 ' A' ' 52' ' ' VAL . 2.8 p -52.48 -32.38 16.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.199 -0.455 . . . . 61.439999999999998 111.168 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 14.2 mtm -67.73 -55.0 14.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 64.209999999999994 110.879 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.5 mttt -54.34 -38.51 66.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 64.209999999999994 110.928 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 1.026 HD11 HG21 ' A' ' 69' ' ' VAL . 88.6 mt -66.05 -54.64 24.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.225 -0.443 . . . . 61.329999999999998 111.149 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.75 HG23 ' HB ' ' A' ' 86' ' ' ILE . 95.1 mt -60.37 -33.88 55.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 64.409999999999997 111.163 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -71.07 -51.84 22.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.176 -0.466 . . . . 54.329999999999998 110.83 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -60.49 -43.09 97.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 72.209999999999994 110.915 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -76.13 -17.78 59.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 74.420000000000002 110.847 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 33.5 mmtm 61.36 52.53 3.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.178 -0.464 . . . . 50.310000000000002 110.891 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.75 ' HB ' HG23 ' A' ' 81' ' ' ILE . 21.2 mt -78.4 131.09 69.59 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.639 0.733 . . . . 72.340000000000003 111.116 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.407 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 53.9 Cg_endo -69.74 158.87 55.5 Favored 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.753 2.302 . . . . 74.420000000000002 112.297 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.41 163.25 16.86 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.183 -0.462 . . . . 63.409999999999997 111.147 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 31' ' ' HIS . 96.2 t -51.01 -58.02 2.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 70.310000000000002 111.169 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -50.85 -46.8 60.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 62.43 110.873 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -59.4 -42.2 91.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 55.210000000000001 110.915 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 12.2 t90 -64.96 -41.55 95.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 62.350000000000001 110.912 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.3 mmtp -62.6 -44.67 95.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.248 -0.433 . . . . 45.109999999999999 110.903 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -64.3 -46.67 82.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.258 -0.428 . . . . 73.200000000000003 110.873 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -57.73 -53.72 55.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 72.530000000000001 110.927 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 4.6 p . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.204 -0.453 . . . . 74.129999999999995 111.081 -179.915 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' -7' ' ' PHE . . . . . 0.467 ' HD2' HD12 ' A' ' 49' ' ' LEU . 9.3 m-85 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.867 0.365 . . . . 74.049999999999997 110.865 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 22.2 mm 51.94 77.6 0.45 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.596 0.713 . . . . 64.349999999999994 111.106 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 92.64 0.51 Allowed 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.712 2.275 . . . . 70.510000000000005 112.324 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.09 28.53 3.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.269 -0.423 . . . . 64.209999999999994 110.884 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' -3' ' ' ARG . . . . . 0.486 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 0.5 OUTLIER -89.64 159.09 44.43 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.58 0.705 . . . . 71.340000000000003 110.883 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' -2' ' ' PRO . . . . . 0.486 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 54.1 Cg_endo -69.78 112.41 3.08 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.669 2.246 . . . . 74.340000000000003 112.356 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' -1' ' ' ALA . . . . . 0.429 ' HA ' ' HD2' ' B' ' 0' ' ' PRO . . . -51.22 108.99 1.18 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.641 0.734 . . . . 64.439999999999998 111.087 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 0' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' B' ' -1' ' ' ALA . 53.9 Cg_endo -69.8 147.14 61.98 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.647 2.231 . . . . 61.420000000000002 112.373 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 60.5 mttt -97.6 160.77 27.88 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.592 0.711 . . . . 73.409999999999997 110.868 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 167.85 23.28 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.654 2.236 . . . . 71.450000000000003 112.372 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.231 0.163 0 C-N-CA 122.666 2.244 . . . . 75.030000000000001 112.372 179.992 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.675 HD12 HD12 ' A' ' 28' ' ' ILE . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.816 0.341 . . . . 75.409999999999997 110.962 . . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -124.48 143.14 50.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 73.430000000000007 110.849 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.913 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -120.88 151.98 39.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 73.409999999999997 111.088 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.495 HG13 ' HB3' ' A' ' 56' ' ' ARG . 6.2 p -120.17 122.19 67.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.196 -0.457 . . . . 64.140000000000001 111.112 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.718 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -60.24 144.53 50.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 52.049999999999997 111.118 -179.942 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.656 HD11 ' HB2' ' A' ' 56' ' ' ARG . 23.3 mt -117.48 -12.17 10.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 64.420000000000002 110.873 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -134.67 164.75 26.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.238 -0.437 . . . . 65.019999999999996 110.94 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -89.97 105.27 17.7 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.133 -0.485 . . . . 75.310000000000002 110.859 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -87.3 123.47 32.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.149 -0.478 . . . . 71.400000000000006 110.861 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.84 96.88 7.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.176 -0.466 . . . . 74.409999999999997 110.905 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.13 157.69 1.75 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.245 -0.434 . . . . 62.25 111.118 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -116.26 -30.6 5.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.21 -0.45 . . . . 72.239999999999995 110.876 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.5 mmm180 -136.2 -177.11 4.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 74.319999999999993 110.869 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -60.39 -41.2 93.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.156 -0.475 . . . . 64.439999999999998 110.873 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -56.93 -39.85 75.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.145 -0.479 . . . . 73.040000000000006 110.864 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -79.87 143.03 34.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.206 -0.452 . . . . 64.310000000000002 110.913 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.8 tp -119.89 127.8 53.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.145 -0.479 . . . . 53.009999999999998 110.869 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -72.94 139.77 46.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.209 -0.451 . . . . 65.439999999999998 110.852 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.718 ' CG1' HG21 ' A' ' 6' ' ' THR . 11.2 p -147.14 151.75 13.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.465 . . . . 72.209999999999994 111.134 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.5 m -110.23 159.91 30.27 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.657 0.741 . . . . 73.140000000000001 110.853 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 120.15 6.98 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.644 2.229 . . . . 71.219999999999999 112.357 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.08 3.64 31.46 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.76 -0.733 . . . . 53.130000000000003 112.496 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -91.97 149.47 21.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.881 0.372 . . . . 64.230000000000004 110.88 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.604 ' CB ' HD12 ' A' ' 42' ' ' ILE . 6.8 m120 -93.79 139.86 30.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 75.409999999999997 110.926 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.724 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 4.4 mp -141.23 145.4 35.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 73.420000000000002 110.903 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.1 113.9 26.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.444 . . . . 62.420000000000002 110.877 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.913 HD11 ' HB2' ' A' ' 4' ' ' ALA . 43.5 mt -77.22 149.76 6.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.153 -0.476 . . . . 73.140000000000001 111.138 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 21.3 m -123.55 -35.91 2.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 71.329999999999998 110.863 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -166.52 173.62 9.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.182 -0.463 . . . . 63.219999999999999 111.085 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.479 ' ND1' HD13 ' A' ' 81' ' ' ILE . 1.6 p80 -124.11 176.28 6.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 71.230000000000004 110.848 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -137.76 99.56 3.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 75.420000000000002 110.887 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.3 t70 55.07 24.92 6.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.105 -0.498 . . . . 74.5 110.895 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.581 ' HD2' HD12 ' A' ' 81' ' ' ILE . 35.0 m-85 64.08 15.69 9.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 63.539999999999999 110.95 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.505 ' O ' HG23 ' A' ' 52' ' ' VAL . 28.1 mm-40 -103.34 -50.65 3.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.125 -0.489 . . . . 72.549999999999997 110.858 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 83.0 m95 -111.5 162.86 14.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.146 -0.479 . . . . 75.239999999999995 110.964 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.635 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.4 OUTLIER -135.93 146.24 47.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.263 -0.426 . . . . 73.510000000000005 110.896 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 11.6 mm -104.12 95.23 3.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.142 -0.481 . . . . 64.219999999999999 111.122 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.724 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -116.42 145.07 43.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.15 -0.477 . . . . 60.409999999999997 111.075 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.0 ptpp? -116.14 157.46 45.12 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.59 0.709 . . . . 74.340000000000003 110.872 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 131.5 21.46 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.713 2.276 . . . . 35.530000000000001 112.339 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.604 HD12 ' CB ' ' A' ' 25' ' ' ASN . 40.5 mt . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.213 -0.449 . . . . 73.299999999999997 111.116 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 N--CA 1.466 -0.118 0 CA-C-O 120.821 0.259 . . . . 35.340000000000003 112.323 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -119.57 -153.52 9.3 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.766 -0.73 . . . . 40.009999999999998 112.52 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -130.32 129.33 43.06 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.856 0.36 . . . . 75.230000000000004 110.91 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.5 p -141.15 132.04 13.42 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.668 0.746 . . . . 71.150000000000006 111.098 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.74 165.51 30.69 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.662 2.241 . . . . 72.420000000000002 112.363 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.729 HG12 ' HB ' ' A' ' 71' ' ' THR . 15.3 t -74.1 -21.24 17.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.24 -0.437 . . . . 61.420000000000002 111.154 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 56.4 m -81.3 1.8 30.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.17 -0.468 . . . . 75.439999999999998 110.832 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.559 ' O ' HG22 ' A' ' 6' ' ' THR . 13.9 m-85 -129.26 22.75 5.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 75.540000000000006 110.911 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 27.5 m -151.3 146.41 16.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 75.109999999999999 111.096 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.656 ' HB2' HD11 ' A' ' 7' ' ' LEU . 33.3 ttp85 -115.64 111.66 20.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 65.540000000000006 110.912 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.4 mm -66.05 118.55 9.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.207 -0.451 . . . . 65.140000000000001 111.074 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.459 HG23 ' HG2' ' A' ' 56' ' ' ARG . 15.3 pt -136.1 165.89 28.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 62.409999999999997 111.147 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -109.21 127.31 54.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 70.319999999999993 110.867 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.9 mt -55.48 -29.59 59.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 71.319999999999993 110.889 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.58 -20.19 28.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 74.030000000000001 110.935 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -161.45 82.1 1.93 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.648 0.737 . . . . 75.439999999999998 110.819 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.737 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.7 Cg_endo -69.75 -8.52 23.81 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.717 2.278 . . . . 72.340000000000003 112.351 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.79 0.25 56.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 75.099999999999994 111.109 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -84.31 -47.15 11.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 74.420000000000002 110.889 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.55 ' O ' HG12 ' A' ' 69' ' ' VAL . 19.0 m-85 -110.98 23.71 13.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 74.420000000000002 110.914 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.737 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -78.07 -20.82 51.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 72.209999999999994 111.077 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 80.9 p -104.59 -8.42 18.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.428 . . . . 71.230000000000004 110.846 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.949 HG21 HD11 ' A' ' 80' ' ' ILE . 9.8 p -51.37 157.84 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 70.519999999999996 111.123 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -104.09 82.46 1.97 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.138 -0.483 . . . . 71.450000000000003 110.871 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.729 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -54.29 -44.64 72.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.448 . . . . 63.409999999999997 111.093 -179.877 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -55.28 -40.92 71.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.239 -0.437 . . . . 63.109999999999999 110.948 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -63.96 108.42 1.49 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.103 -0.499 . . . . 73.230000000000004 110.852 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ARG . . . . . 0.404 ' HA ' HG12 ' A' ' 77' ' ' VAL . 0.2 OUTLIER -51.97 -29.3 19.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.455 . . . . 61.219999999999999 110.876 -179.908 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -66.98 -56.42 10.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 73.400000000000006 110.869 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -54.9 41.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.461 . . . . 70.230000000000004 110.936 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.52 ' HA ' HD12 ' A' ' 80' ' ' ILE . 4.8 p -54.27 -32.68 24.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 74.239999999999995 111.121 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.4 mtm -67.37 -56.04 11.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.474 . . . . 73.319999999999993 110.817 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -54.62 -37.51 65.71 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.247 -0.433 . . . . 64.430000000000007 110.911 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.949 HD11 HG21 ' A' ' 69' ' ' VAL . 27.9 mt -66.22 -55.1 20.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 70.310000000000002 111.14 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.72 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.4 mt -60.51 -36.73 71.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.153 -0.476 . . . . 70.430000000000007 111.149 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -70.93 -46.73 61.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.156 -0.475 . . . . 75.329999999999998 110.857 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -64.42 -47.1 80.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 75.319999999999993 110.853 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -72.34 -12.84 61.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 73.209999999999994 110.898 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.56 53.06 6.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.137 -0.483 . . . . 72.140000000000001 110.881 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.72 ' HB ' HG23 ' A' ' 81' ' ' ILE . 59.0 mt -83.73 132.94 47.44 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.64 0.733 . . . . 75.409999999999997 111.105 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.418 ' HD2' HG23 ' A' ' 86' ' ' ILE . 53.5 Cg_endo -69.76 163.83 36.81 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.705 2.27 . . . . 71.140000000000001 112.324 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.28 169.2 9.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.173 -0.467 . . . . 72.019999999999996 111.135 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 91.7 t -51.43 -56.53 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 71.510000000000005 111.131 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -52.43 -52.13 55.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 63.119999999999997 110.857 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 57.7 mm-40 -56.86 -42.68 80.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 55.140000000000001 110.886 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.45 ' O ' HG23 ' A' ' 96' ' ' THR . 33.4 t90 -66.1 -36.93 84.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 75.209999999999994 110.898 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -68.43 -35.03 77.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 74.420000000000002 110.892 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -72.16 -49.46 35.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 63.140000000000001 110.834 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.4 ' HG2' ' HA ' ' A' ' 92' ' ' TRP . 21.0 pt20 -61.56 -39.94 92.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 71.540000000000006 110.905 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.45 HG23 ' O ' ' A' ' 92' ' ' TRP . 38.1 p . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 73.239999999999995 111.153 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.838 0.351 . . . . 75.109999999999999 110.868 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.0 mm 51.83 81.0 0.27 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.607 0.718 . . . . 64.349999999999994 111.092 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 81.43 0.82 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.671 2.247 . . . . 73.329999999999998 112.309 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 5.4 t -97.21 37.27 1.35 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 72.099999999999994 110.861 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' -3' ' ' ARG . . . . . 0.446 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 5.6 mmm180 -98.16 160.56 27.98 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.596 0.713 . . . . 54.450000000000003 110.879 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' -2' ' ' PRO . . . . . 0.446 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.6 Cg_endo -69.79 99.53 0.76 Allowed 'Trans proline' 0 C--N 1.34 0.13 0 C-N-CA 122.657 2.238 . . . . 74.439999999999998 112.31 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -51.13 108.96 1.17 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.542 0.687 . . . . 62.439999999999998 111.094 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 154.25 67.98 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.704 2.269 . . . . 74.510000000000005 112.334 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 12.7 mtpp -99.56 160.66 26.83 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.539 0.685 . . . . 73.239999999999995 110.87 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 167.82 23.32 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.693 2.262 . . . . 62.119999999999997 112.335 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--N 1.341 0.149 0 C-N-CA 122.683 2.255 . . . . 62.32 112.359 179.933 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.777 HD12 HD13 ' A' ' 86' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.826 0.346 . . . . 53.130000000000003 110.923 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.463 ' CE2' HD12 ' A' ' 60' ' ' LEU . 97.1 m-85 -128.55 139.55 52.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.466 . . . . 61.450000000000003 110.866 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.477 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -133.93 159.55 40.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.49 . . . . 34.32 111.111 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.6 p -124.75 127.05 72.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 70.420000000000002 111.11 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.665 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -67.04 126.95 30.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.209 -0.451 . . . . 53.299999999999997 111.106 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.553 HD11 ' HB2' ' A' ' 56' ' ' ARG . 66.1 mt -101.73 -17.68 16.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 50.32 110.906 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -132.87 160.82 35.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 72.299999999999997 110.889 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -86.42 105.08 16.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.084 -0.507 . . . . 72.329999999999998 110.852 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -84.81 126.17 33.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 65.109999999999999 110.894 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.4 mttm -101.91 100.17 10.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.119 -0.491 . . . . 70.319999999999993 110.905 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.74 149.68 5.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 70.299999999999997 111.091 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -123.05 -36.34 2.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 73.019999999999996 110.884 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.9 mmt180 -114.56 -178.19 3.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 75.140000000000001 110.861 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -68.36 -35.68 78.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 71.230000000000004 110.865 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -67.96 -41.17 82.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.242 -0.436 . . . . 61.25 110.858 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.15 166.77 3.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 63.020000000000003 110.904 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.2 tp -142.37 149.96 40.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 44.439999999999998 110.948 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -94.67 131.46 40.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 71.530000000000001 110.867 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.665 ' CG1' HG21 ' A' ' 6' ' ' THR . 14.8 p -148.59 149.49 15.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 72.439999999999998 111.101 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.9 m -110.67 160.43 28.7 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.646 0.736 . . . . 74.439999999999998 110.859 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 128.2 15.67 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.71 2.273 . . . . 72.219999999999999 112.334 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.09 -6.02 32.28 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.709 -0.758 . . . . 54.119999999999997 112.509 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -92.2 155.18 18.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.852 0.358 . . . . 51.530000000000001 110.871 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.69 ' C ' HD22 ' A' ' 26' ' ' LEU . 7.1 m120 -96.14 139.25 32.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.030000000000001 110.917 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.69 HD22 ' C ' ' A' ' 25' ' ' ASN . 3.5 mm? -131.57 142.01 49.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.18 -0.464 . . . . 72.129999999999995 110.886 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.82 116.78 33.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.209 -0.45 . . . . 44.130000000000003 110.842 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.599 ' HB ' HD13 ' A' ' 2' ' ' LEU . 26.4 mt -84.08 146.01 7.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.106 -0.497 . . . . 72.209999999999994 111.115 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 22.9 m -118.53 -27.76 5.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 65.150000000000006 110.828 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.44 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -169.67 178.48 4.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.45 . . . . 65.530000000000001 111.128 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.469 ' ND1' HD13 ' A' ' 81' ' ' ILE . 1.6 p80 -129.47 176.59 7.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.254 -0.43 . . . . 72.319999999999993 110.862 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -137.89 99.4 3.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 74.099999999999994 110.857 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 46.6 t0 54.31 25.69 6.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 72.450000000000003 110.831 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.603 ' HD2' HD12 ' A' ' 81' ' ' ILE . 25.6 m-85 63.26 23.1 13.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.194 -0.457 . . . . 62.140000000000001 110.958 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.49 ' O ' HG23 ' A' ' 52' ' ' VAL . 21.9 mm-40 -111.79 -53.3 2.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.505 . . . . 73.329999999999998 110.899 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 79.9 m95 -109.13 144.26 37.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.152 -0.477 . . . . 74.549999999999997 110.929 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.79 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.4 OUTLIER -117.59 130.09 56.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.435 . . . . 75.150000000000006 110.873 -179.965 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.1 mm -87.9 95.11 4.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.119 -0.491 . . . . 65.109999999999999 111.153 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.683 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.09 157.75 19.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 60.130000000000003 111.066 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -132.33 157.94 76.93 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.558 0.694 . . . . 72.230000000000004 110.872 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 115.15 3.95 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.679 2.253 . . . . 75.230000000000004 112.324 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.8 mt . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.469 . . . . 75.409999999999997 111.145 179.887 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 N--CA 1.466 -0.124 0 CA-C-O 120.801 0.25 . . . . 71.25 112.353 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -128.17 -144.97 5.96 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.746 -0.74 . . . . 13.130000000000001 112.514 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -147.98 129.87 15.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.869 0.366 . . . . 71.209999999999994 110.867 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.0 p -142.36 132.83 12.59 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.634 0.731 . . . . 72.140000000000001 111.101 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.572 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.6 Cg_endo -69.78 152.27 69.18 Favored 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.656 2.238 . . . . 74.150000000000006 112.355 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.79 HG22 ' CD2' ' A' ' 37' ' ' PHE . 13.7 t -62.52 -22.31 29.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.225 -0.443 . . . . 72.219999999999999 111.146 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.9 t -78.04 -3.18 40.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.144 -0.48 . . . . 72.349999999999994 110.889 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -123.57 18.05 9.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 64.349999999999994 110.938 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.572 HG22 ' O ' ' A' ' 51' ' ' PRO . 3.8 m -153.95 149.41 12.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.093 -0.503 . . . . 72.329999999999998 111.142 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.553 ' HB2' HD11 ' A' ' 7' ' ' LEU . 21.4 ttm180 -116.41 118.12 31.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.47 . . . . 72.219999999999999 110.897 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.598 HG23 HD21 ' A' ' 2' ' ' LEU . 24.3 mm -70.12 116.47 11.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 44.32 111.132 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.534 HG23 ' HG2' ' A' ' 56' ' ' ARG . 11.3 pt -134.71 172.02 16.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.479 . . . . 61.409999999999997 111.122 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -115.06 147.17 40.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.171 -0.468 . . . . 55.240000000000002 110.85 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.463 HD12 ' CE2' ' A' ' 3' ' ' PHE . 13.2 mt -72.59 -35.54 67.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.455 . . . . 71.549999999999997 110.932 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 21.1 mmt -81.93 -25.21 35.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.142 -0.481 . . . . 70.430000000000007 110.865 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -151.94 74.13 7.77 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.605 0.717 . . . . 73.099999999999994 110.88 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.63 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.8 Cg_endo -69.71 -8.62 24.07 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.662 2.241 . . . . 75.239999999999995 112.381 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.73 -14.77 25.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.195 -0.457 . . . . 42.210000000000001 111.071 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -75.01 -51.96 12.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.273 -0.421 . . . . 75.340000000000003 110.913 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.617 ' O ' HG12 ' A' ' 69' ' ' VAL . 83.8 m-85 -95.4 23.02 6.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 74.230000000000004 110.908 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.63 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -87.57 -21.17 25.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.118 -0.492 . . . . 72.140000000000001 111.113 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.6 t -95.37 -21.12 18.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.439 . . . . 72.540000000000006 110.865 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.874 HG21 HD11 ' A' ' 80' ' ' ILE . 10.7 p -51.57 149.22 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.116 -0.493 . . . . 72.340000000000003 111.133 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -99.32 105.77 17.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 73.129999999999995 110.835 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.741 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -68.37 -39.72 81.68 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.146 -0.479 . . . . 71.230000000000004 111.115 -179.874 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 35.2 t80 -54.05 -44.31 70.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 74.349999999999994 110.922 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.99 108.94 1.63 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 72.340000000000003 110.854 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.6 -25.18 37.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 74.120000000000005 110.839 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -66.48 -54.75 20.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.185 -0.462 . . . . 74.319999999999993 110.948 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.27 -57.09 14.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.079 -0.509 . . . . 64.349999999999994 110.943 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -52.66 -31.56 16.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 70.040000000000006 111.132 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.9 mtm -68.25 -54.31 18.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.135 -0.484 . . . . 62.25 110.849 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.0 mttm -55.69 -39.95 71.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.43 . . . . 75.209999999999994 110.857 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.874 HD11 HG21 ' A' ' 69' ' ' VAL . 67.4 mt -64.93 -54.36 30.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 53.200000000000003 111.108 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.669 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.9 mt -59.98 -29.65 43.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 74.219999999999999 111.128 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -70.76 -52.7 19.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 75.430000000000007 110.855 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.01 -31.37 71.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 72.420000000000002 110.898 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -81.32 -6.48 58.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.156 -0.475 . . . . 71.349999999999994 110.852 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 50.7 42.81 27.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.163 -0.471 . . . . 41.350000000000001 110.923 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.777 HD13 HD12 ' A' ' 2' ' ' LEU . 3.8 mt -81.01 119.06 74.95 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.665 0.745 . . . . 75.319999999999993 111.091 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.44 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 53.8 Cg_endo -69.77 155.8 64.97 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.699 2.266 . . . . 64.150000000000006 112.336 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.19 176.97 9.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.444 . . . . 55.43 111.129 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.8 t -57.67 -53.02 50.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.221 -0.445 . . . . 72.230000000000004 111.099 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -51.63 -49.19 62.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 61.329999999999998 110.887 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 67.6 mm-40 -58.82 -41.13 86.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 71.349999999999994 110.892 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 30.0 t90 -64.68 -42.61 95.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.195 -0.457 . . . . 71.430000000000007 110.911 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -61.98 -50.42 72.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.451 . . . . 75.209999999999994 110.915 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -61.43 -41.35 97.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 75.209999999999994 110.86 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -59.88 -51.07 71.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 74.409999999999997 110.855 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.1 p . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.24 -0.436 . . . . 70.439999999999998 111.13 -179.883 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.804 0.335 . . . . 64.109999999999999 110.832 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 23.8 mm 51.31 77.97 0.43 Allowed Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.632 0.729 . . . . 53.219999999999999 111.131 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 90.96 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.66 2.24 . . . . 53.420000000000002 112.32 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 16.3 t -102.79 34.56 2.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 72.019999999999996 110.853 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' -3' ' ' ARG . . . . . 0.427 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 3.3 mtp85 -95.31 160.3 30.97 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.554 0.693 . . . . 74.450000000000003 110.93 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' -2' ' ' PRO . . . . . 0.427 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.9 Cg_endo -69.78 102.51 1.04 Allowed 'Trans proline' 0 N--CA 1.466 -0.145 0 C-N-CA 122.718 2.279 . . . . 55.240000000000002 112.381 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -51.05 108.9 1.15 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.615 0.721 . . . . 64.299999999999997 111.139 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.71 150.94 69.18 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.745 2.297 . . . . 71.430000000000007 112.301 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -97.95 160.87 27.38 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.53 0.681 . . . . 73.120000000000005 110.92 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.76 167.88 23.16 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.649 2.232 . . . . 74.030000000000001 112.368 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--N 1.342 0.186 0 C-N-CA 122.61 2.207 . . . . 73.519999999999996 112.373 179.938 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.768 HD11 HG13 ' A' ' 28' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.838 0.351 . . . . 65.319999999999993 110.889 . . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.638 ' CD1' HD13 ' A' ' 60' ' ' LEU . 95.0 m-85 -134.65 140.01 45.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 74.319999999999993 110.902 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -111.24 169.76 8.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.485 . . . . 71.409999999999997 111.063 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.415 HG12 HG12 ' A' ' 58' ' ' ILE . 7.6 p -136.94 124.93 33.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.459 . . . . 61.520000000000003 111.1 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.773 HG21 HG11 ' A' ' 20' ' ' VAL . 0.2 OUTLIER -73.07 147.48 44.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 74.439999999999998 111.161 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.511 HD11 ' HB2' ' A' ' 56' ' ' ARG . 18.0 mt -118.14 -11.82 10.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.234 -0.439 . . . . 73.140000000000001 110.909 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -140.18 166.91 23.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 74.340000000000003 110.967 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -89.88 110.04 21.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 64.230000000000004 110.896 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.469 ' HB3' HG12 ' A' ' 20' ' ' VAL . 23.0 t80 -91.43 116.15 28.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 75.540000000000006 110.887 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.56 108.44 19.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.497 . . . . 72.140000000000001 110.878 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.27 158.98 15.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 75.25 111.09 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -124.68 -37.14 2.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.256 -0.429 . . . . 60.100000000000001 110.872 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.8 mmt180 -122.29 167.16 13.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.475 . . . . 75.5 110.875 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -53.63 -40.76 66.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 65.319999999999993 110.887 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -65.04 -25.35 67.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.254 -0.43 . . . . 75.319999999999993 110.858 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -90.29 129.07 36.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 72.409999999999997 110.909 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.8 tp -108.29 145.07 34.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 61.030000000000001 110.879 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -89.09 150.26 22.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 75.319999999999993 110.876 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.773 HG11 HG21 ' A' ' 6' ' ' THR . 8.8 p -147.43 156.16 10.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 74.230000000000004 111.136 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 14.1 p -111.02 154.51 43.41 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.638 0.732 . . . . 54.340000000000003 110.879 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 128.17 15.66 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.691 2.261 . . . . 74.25 112.402 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.8 -2.93 60.48 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.794 -0.717 . . . . 63.030000000000001 112.521 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -85.6 158.41 20.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.846 0.355 . . . . 74.129999999999995 110.901 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.488 ' C ' HD22 ' A' ' 26' ' ' LEU . 3.4 m120 -101.39 131.95 47.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 71.409999999999997 110.903 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.819 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 3.1 mm? -123.66 159.97 28.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.161 -0.472 . . . . 74.140000000000001 110.918 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.81 112.88 25.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.446 . . . . 72.310000000000002 110.89 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.768 HG13 HD11 ' A' ' 2' ' ' LEU . 38.2 mm -70.88 143.27 14.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.126 -0.488 . . . . 71.349999999999994 111.169 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.2 m -122.92 -35.83 2.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 50.119999999999997 110.861 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.477 ' HB1' ' C ' ' A' ' 88' ' ' THR . . . -170.78 173.4 5.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 74.140000000000001 111.118 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.566 ' O ' HG23 ' A' ' 89' ' ' VAL . 1.8 p80 -128.12 176.18 7.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 73.109999999999999 110.859 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -137.78 99.86 4.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 73.209999999999994 110.902 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.5 t0 54.4 25.75 6.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.119 -0.491 . . . . 73.439999999999998 110.798 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.595 ' HD2' HD12 ' A' ' 81' ' ' ILE . 37.6 m-85 63.27 26.34 15.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.224 -0.443 . . . . 74.430000000000007 110.911 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.466 ' O ' HG23 ' A' ' 52' ' ' VAL . 16.9 mm-40 -115.64 -46.56 2.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.103 -0.499 . . . . 72.420000000000002 110.882 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.413 ' HB3' HD21 ' A' ' 49' ' ' LEU . 82.5 m95 -114.73 146.95 40.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.177 -0.465 . . . . 75.409999999999997 110.894 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.62 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -123.82 143.66 50.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 71.109999999999999 110.902 -179.999 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.45 HG21 ' CZ3' ' A' ' 92' ' ' TRP . 19.6 mm -101.22 98.49 6.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 43.439999999999998 111.131 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.819 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.86 138.36 47.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.155 -0.475 . . . . 62.420000000000002 111.131 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -112.59 157.56 39.94 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.571 0.7 . . . . 70.120000000000005 110.906 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 131.24 20.87 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.659 2.239 . . . . 62.020000000000003 112.388 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.468 HD12 ' CB ' ' A' ' 25' ' ' ASN . 35.9 mt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.227 -0.442 . . . . 74.120000000000005 111.134 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.23 0.122 0 CA-C-O 120.843 0.268 . . . . 63.039999999999999 112.312 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -117.68 -166.87 14.07 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.776 -0.726 . . . . 43.329999999999998 112.541 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.505 HD12 ' CD2' ' B' ' -7' ' ' PHE . 0.4 OUTLIER -120.9 124.83 45.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.897 0.38 . . . . 63.219999999999999 110.857 -179.898 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.435 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.2 p -134.94 133.13 20.75 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.635 0.731 . . . . 71.209999999999994 111.132 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.494 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.6 Cg_endo -69.75 153.87 68.44 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.721 2.281 . . . . 75.540000000000006 112.332 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.744 HG12 ' HB ' ' A' ' 71' ' ' THR . 11.8 t -65.55 -21.65 29.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.204 -0.453 . . . . 72.230000000000004 111.151 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 7.1 m -78.57 -1.86 36.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 62.140000000000001 110.8 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -121.38 2.18 10.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.185 -0.461 . . . . 62.229999999999997 110.921 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.494 HG22 ' O ' ' A' ' 51' ' ' PRO . 17.0 m -139.45 160.16 28.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.493 . . . . 62.310000000000002 111.111 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.511 ' HB2' HD11 ' A' ' 7' ' ' LEU . 17.9 ttm180 -127.26 123.64 36.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.167 -0.47 . . . . 71.540000000000006 110.862 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.482 HD11 ' CE2' ' A' ' 37' ' ' PHE . 24.8 mm -74.39 110.29 8.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.471 . . . . 35.109999999999999 111.129 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.449 HG23 ' HG2' ' A' ' 56' ' ' ARG . 6.7 pt -124.27 -177.87 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.155 -0.475 . . . . 75.319999999999993 111.138 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -128.64 145.9 51.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 71.549999999999997 110.908 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.638 HD13 ' CD1' ' A' ' 3' ' ' PHE . 1.5 mp -73.29 -38.3 65.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 71.209999999999994 110.926 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.83 -24.12 52.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 72.439999999999998 110.912 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -155.31 75.96 5.16 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.626 0.727 . . . . 73.439999999999998 110.856 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.718 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 54.3 Cg_endo -69.72 -8.32 23.31 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.663 2.242 . . . . 64.329999999999998 112.367 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.81 -15.36 23.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.447 . . . . 44.310000000000002 111.085 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -77.73 -51.66 10.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.252 -0.431 . . . . 64.329999999999998 110.914 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.429 ' HA ' HG23 ' A' ' 69' ' ' VAL . 57.1 m-85 -95.35 23.15 6.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.255 -0.429 . . . . 74.450000000000003 110.915 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.718 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -88.03 -23.81 23.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.095 -0.502 . . . . 70.209999999999994 111.1 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 13.0 p -91.68 -9.72 42.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 65.310000000000002 110.835 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.429 HG23 ' HA ' ' A' ' 66' ' ' TYR . 55.2 t -51.49 139.94 6.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.14 -0.482 . . . . 65.5 111.101 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -94.77 75.42 3.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.476 . . . . 73.409999999999997 110.867 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.744 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -46.92 -34.58 5.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 65.430000000000007 111.127 -179.886 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -57.94 -45.19 86.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 71.319999999999993 110.903 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -69.67 114.82 8.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 74.530000000000001 110.903 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.08 -23.98 37.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.214 -0.448 . . . . 71.010000000000005 110.858 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -66.81 -57.68 6.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 74.209999999999994 110.843 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.692 ' O ' HD12 ' A' ' 80' ' ' ILE . 4.2 mm-40 -57.64 -57.59 12.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 70.030000000000001 110.944 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.7 p -51.43 -32.12 12.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 72.219999999999999 111.162 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.7 mtm -68.17 -51.64 43.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.476 . . . . 73.400000000000006 110.852 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.9 mttm -55.83 -42.67 76.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 74.019999999999996 110.904 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.692 HD12 ' O ' ' A' ' 76' ' ' GLN . 1.6 mp -64.79 -55.04 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 53.030000000000001 111.149 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.595 HD12 ' HD2' ' A' ' 34' ' ' TYR . 90.5 mt -57.7 -37.53 59.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 74.340000000000003 111.087 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -71.08 -52.02 21.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 73.420000000000002 110.896 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -58.94 -51.35 70.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 65.340000000000003 110.844 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -68.66 -14.1 62.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.145 -0.479 . . . . 71.530000000000001 110.883 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? 58.76 54.23 5.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 74.510000000000005 110.914 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.537 ' HB ' HG23 ' A' ' 81' ' ' ILE . 22.6 mt -81.74 131.19 58.3 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.655 0.74 . . . . 75.239999999999995 111.134 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 158.23 57.66 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.685 2.257 . . . . 71.219999999999999 112.363 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.477 ' C ' ' HB1' ' A' ' 30' ' ' ALA . 0.1 OUTLIER -85.37 169.94 13.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 74.200000000000003 111.164 -179.957 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.829 HG12 ' HE2' ' A' ' 93' ' ' LYS . 25.4 t -51.51 -52.04 22.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 71.329999999999998 111.116 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -59.87 -47.48 85.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 42.130000000000003 110.891 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -57.48 -27.84 62.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.127 -0.488 . . . . 45.009999999999998 110.94 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.45 ' CZ3' HG21 ' A' ' 38' ' ' ILE . 26.8 t90 -73.27 -48.01 38.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 72.530000000000001 110.94 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.829 ' HE2' HG12 ' A' ' 89' ' ' VAL . 11.6 mtmt -64.86 -39.97 94.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.219 -0.446 . . . . 75.129999999999995 110.905 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -70.23 -43.51 70.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.464 . . . . 72.319999999999993 110.867 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 39.7 mm-40 -61.37 -45.96 92.19 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.18 -0.464 . . . . 72.109999999999999 110.917 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.3 p . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 73.310000000000002 111.141 -179.94 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' -7' ' ' PHE . . . . . 0.505 ' CD2' HD12 ' A' ' 49' ' ' LEU . 28.8 m-85 . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.803 0.335 . . . . 73.25 110.837 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 27.9 mm 51.39 76.21 0.57 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.573 0.701 . . . . 43.299999999999997 111.153 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 104.58 1.34 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.693 2.262 . . . . 75.120000000000005 112.354 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 31.0 t -96.47 5.08 51.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 54.409999999999997 110.829 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -51.68 162.15 0.78 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.637 0.732 . . . . 74.319999999999993 110.891 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -19.09 36.76 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.669 2.246 . . . . 74.109999999999999 112.357 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 63.69 82.6 0.21 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.628 0.728 . . . . 62.439999999999998 111.117 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 140.75 43.47 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.681 2.254 . . . . 53.109999999999999 112.349 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 26.3 mtmm -72.14 160.72 81.95 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.582 0.706 . . . . 55.350000000000001 110.889 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 167.75 23.54 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.704 2.269 . . . . 64.019999999999996 112.329 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 C--N 1.342 0.208 0 C-N-CA 122.638 2.226 . . . . 65.450000000000003 112.367 179.919 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.5 pp . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.858 0.361 . . . . 73.230000000000004 110.885 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -128.97 148.17 50.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 71.299999999999997 110.902 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.439 ' HB2' ' CD1' ' A' ' 28' ' ' ILE . . . -122.7 168.6 12.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.137 -0.483 . . . . 73.25 111.09 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.4 p -134.27 130.17 54.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 64.109999999999999 111.127 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.738 HG21 HG11 ' A' ' 20' ' ' VAL . 0.9 OUTLIER -72.74 142.47 48.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 73.430000000000007 111.143 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.74 HD11 ' HB2' ' A' ' 56' ' ' ARG . 5.7 mt -117.6 -17.1 10.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.452 . . . . 70.430000000000007 110.91 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -129.29 167.95 16.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.178 -0.465 . . . . 74.140000000000001 110.949 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -92.14 112.19 24.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.119 -0.491 . . . . 74.239999999999995 110.868 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -92.17 123.16 35.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.129 -0.487 . . . . 72.010000000000005 110.92 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.9 mttt -101.96 101.01 11.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 75.230000000000004 110.958 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.451 ' HB1' ' HB3' ' A' ' 17' ' ' GLU . . . -61.17 155.65 20.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.439 . . . . 72.299999999999997 111.109 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -122.72 -35.99 2.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 75.219999999999999 110.841 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -121.67 -176.49 3.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.156 -0.475 . . . . 71.099999999999994 110.844 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -68.23 -38.45 81.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 65.109999999999999 110.855 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -63.7 -32.95 74.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 71.140000000000001 110.846 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.451 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 0.6 OUTLIER -79.3 147.71 32.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.436 . . . . 75.340000000000003 110.846 -179.888 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.413 HD22 ' HA3' ' A' ' 48' ' ' GLY . 8.7 tp -127.5 121.6 31.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.113 -0.494 . . . . 74.140000000000001 110.909 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -77.32 144.07 38.32 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.236 -0.438 . . . . 72.219999999999999 110.882 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.738 HG11 HG21 ' A' ' 6' ' ' THR . 7.0 p -149.89 154.71 8.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 62.140000000000001 111.176 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.0 m -105.84 156.14 37.11 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.715 0.769 . . . . 74.439999999999998 110.864 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.86 139.88 40.96 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.703 2.269 . . . . 74.0 112.341 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.35 -4.99 74.32 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.741 -0.742 . . . . 64.040000000000006 112.461 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -89.54 146.08 24.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.868 0.366 . . . . 74.340000000000003 110.918 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -89.76 123.7 33.99 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 65.409999999999997 110.884 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.782 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 3.3 mm? -116.08 145.64 42.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 72.430000000000007 110.877 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.2 t -101.24 112.89 25.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.154 -0.475 . . . . 45.350000000000001 110.862 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.439 ' CD1' ' HB2' ' A' ' 4' ' ' ALA . 56.6 mt -78.36 144.57 11.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.099 -0.5 . . . . 74.420000000000002 111.141 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.2 m -117.95 -41.94 2.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.18 -0.464 . . . . 73.400000000000006 110.837 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.37 175.35 14.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 54.210000000000001 111.081 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.411 ' O ' HG22 ' A' ' 88' ' ' THR . 2.4 p80 -127.22 178.52 5.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 75.439999999999998 110.838 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -150.88 107.22 3.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.212 -0.449 . . . . 74.430000000000007 110.951 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 57.62 20.07 5.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.143 -0.481 . . . . 73.409999999999997 110.906 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.636 ' HD2' HD12 ' A' ' 81' ' ' ILE . 32.7 m-85 58.84 21.88 9.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 72.329999999999998 110.912 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -118.17 -24.81 6.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 71.120000000000005 110.866 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -130.23 135.87 48.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 73.230000000000004 110.903 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.614 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -118.56 138.79 52.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.254 -0.43 . . . . 74.439999999999998 110.859 -179.942 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.2 mm -93.77 94.17 4.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 71.450000000000003 111.119 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.782 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -109.97 149.64 29.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 73.319999999999993 111.11 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.2 pttp -124.9 158.01 64.42 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.576 0.703 . . . . 74.439999999999998 110.913 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 153.94 68.29 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.671 2.248 . . . . 73.109999999999999 112.343 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.416 ' O ' HG22 ' A' ' 42' ' ' ILE . 29.0 mt . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 72.010000000000005 111.118 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 N--CA 1.465 -0.16 0 CA-C-O 120.794 0.248 . . . . 52.310000000000002 112.351 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.413 ' HA3' HD22 ' A' ' 18' ' ' LEU . . . -121.79 163.69 15.15 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.697 -0.763 . . . . 34.43 112.476 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.558 HD12 ' HB3' ' B' ' -7' ' ' PHE . 1.0 OUTLIER -108.89 124.68 51.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.853 0.359 . . . . 73.299999999999997 110.933 -179.938 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.444 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.2 p -143.3 133.21 11.94 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.665 0.745 . . . . 53.229999999999997 111.119 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.444 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.2 Cg_endo -69.76 152.42 69.29 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.707 2.271 . . . . 52.439999999999998 112.284 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.73 HG12 ' HB ' ' A' ' 71' ' ' THR . 12.4 t -64.92 -20.75 28.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 60.130000000000003 111.132 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.6 m -79.56 0.41 29.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 74.409999999999997 110.837 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.402 ' CD1' ' HG2' ' A' ' 51' ' ' PRO . 27.5 m-85 -127.63 18.61 6.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 72.200000000000003 110.926 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.5 m -151.9 160.29 3.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.097 -0.501 . . . . 74.430000000000007 111.109 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.74 ' HB2' HD11 ' A' ' 7' ' ' LEU . 20.1 ttp180 -123.62 129.43 51.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 74.150000000000006 110.885 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 44.6 mm -81.89 111.95 19.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 72.430000000000007 111.169 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.589 HG23 ' HG2' ' A' ' 56' ' ' ARG . 13.6 pt -129.98 -178.28 2.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 54.450000000000003 111.125 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -129.15 129.63 45.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.189 -0.46 . . . . 75.310000000000002 110.85 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.4 mt -55.19 -26.2 37.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 64.510000000000005 110.89 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.51 -30.77 16.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 72.109999999999999 110.873 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -141.05 73.92 26.03 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.578 0.704 . . . . 75.450000000000003 110.862 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.641 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.8 Cg_endo -69.8 -13.77 35.02 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.66 2.24 . . . . 64.349999999999994 112.312 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.99 -16.14 20.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.237 -0.438 . . . . 61.329999999999998 111.122 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.9 ttmt -74.26 -52.17 13.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 73.25 110.89 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.618 ' O ' HG12 ' A' ' 69' ' ' VAL . 68.0 m-85 -95.41 23.17 6.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.195 -0.457 . . . . 64.420000000000002 110.931 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.641 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -87.0 -18.76 29.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 52.240000000000002 111.068 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.3 p -95.93 -21.22 18.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.24 -0.436 . . . . 64.040000000000006 110.825 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.937 HG21 HD11 ' A' ' 80' ' ' ILE . 9.6 p -51.45 145.54 2.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.138 -0.483 . . . . 71.409999999999997 111.107 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.44 106.43 18.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.173 -0.467 . . . . 71.049999999999997 110.852 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.73 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -70.59 -35.79 73.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 74.450000000000003 111.097 -179.861 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -60.66 -41.52 95.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.186 -0.461 . . . . 70.420000000000002 110.928 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 57.4 t0 -63.94 107.85 1.34 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.138 -0.483 . . . . 72.430000000000007 110.854 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.15 -27.08 31.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 61.240000000000002 110.868 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -67.15 -55.26 14.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 65.329999999999998 110.912 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -59.71 -56.58 20.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 71.219999999999999 110.879 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.48 ' HA ' HD12 ' A' ' 80' ' ' ILE . 2.4 p -52.81 -31.7 16.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 51.210000000000001 111.131 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 11.4 mtm -68.02 -56.08 10.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 61.049999999999997 110.932 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 41.1 mttm -54.84 -36.96 65.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 75.439999999999998 110.919 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.937 HD11 HG21 ' A' ' 69' ' ' VAL . 27.0 mt -66.91 -55.18 18.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 71.120000000000005 111.116 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.701 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.9 mt -60.57 -36.05 67.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.461 . . . . 72.120000000000005 111.092 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -71.27 -50.17 35.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 74.530000000000001 110.864 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -62.82 -47.04 85.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 62.210000000000001 110.884 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -70.72 -14.08 62.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 63.219999999999999 110.908 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.85 54.94 4.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.483 . . . . 74.439999999999998 110.856 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.701 ' HB ' HG23 ' A' ' 81' ' ' ILE . 49.9 mt -85.12 132.18 46.27 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.602 0.715 . . . . 62.229999999999997 111.125 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 161.07 47.36 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.671 2.247 . . . . 65.120000000000005 112.361 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.411 HG22 ' O ' ' A' ' 31' ' ' HIS . 0.2 OUTLIER -97.31 165.67 11.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.248 -0.433 . . . . 73.420000000000002 111.203 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 87.2 t -50.84 -52.66 16.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.262 -0.427 . . . . 60.32 111.112 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -52.22 -52.17 53.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 72.019999999999996 110.931 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -58.04 -42.75 86.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.148 -0.478 . . . . 74.430000000000007 110.912 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.434 ' O ' HG23 ' A' ' 96' ' ' THR . 55.5 t90 -65.32 -36.26 83.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.219 -0.446 . . . . 73.120000000000005 110.94 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? -68.29 -37.82 81.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 64.540000000000006 110.907 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -69.81 -50.52 42.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 62.530000000000001 110.885 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.4 ' HG2' ' HA ' ' A' ' 92' ' ' TRP . 4.3 pt20 -59.89 -39.66 86.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 74.349999999999994 110.901 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.434 HG23 ' O ' ' A' ' 92' ' ' TRP . 30.8 p . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 73.319999999999993 111.163 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' -7' ' ' PHE . . . . . 0.558 ' HB3' HD12 ' A' ' 49' ' ' LEU . 31.3 m-85 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.796 0.331 . . . . 72.430000000000007 110.896 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 22.1 mm 50.25 78.22 0.41 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.611 0.719 . . . . 55.109999999999999 111.14 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 97.09 0.62 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.661 2.241 . . . . 64.439999999999998 112.337 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 28.7 t -95.99 3.28 53.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.197 -0.456 . . . . 70.140000000000001 110.863 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.54 162.39 0.71 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.637 0.732 . . . . 74.25 110.874 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 -17.94 37.17 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.674 2.249 . . . . 71.519999999999996 112.322 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 63.89 84.04 0.19 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.618 0.723 . . . . 60.030000000000001 111.097 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 140.01 41.79 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.696 2.264 . . . . 64.019999999999996 112.36 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -73.6 160.59 81.87 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.602 0.715 . . . . 73.040000000000006 110.909 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 167.1 25.47 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.667 2.245 . . . . 74.219999999999999 112.323 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo . . . . . 0 N--CA 1.465 -0.17 0 C-N-CA 122.703 2.269 . . . . 74.109999999999999 112.401 179.915 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.568 ' CD1' HD12 ' A' ' 28' ' ' ILE . 1.1 pp . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.826 0.346 . . . . 75.319999999999993 110.924 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -126.03 156.65 39.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 61.140000000000001 110.848 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.924 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -133.43 156.05 48.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 63.0 111.088 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.473 HG13 ' HB3' ' A' ' 56' ' ' ARG . 6.1 p -123.36 121.63 63.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 73.439999999999998 111.187 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.703 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -64.95 140.73 58.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 75.329999999999998 111.169 -179.952 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.76 HD11 ' HB2' ' A' ' 56' ' ' ARG . 8.2 mt -116.71 -13.87 10.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.262 -0.426 . . . . 73.319999999999993 110.923 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -134.98 158.58 43.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.172 -0.467 . . . . 72.099999999999994 110.939 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.56 105.22 14.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.117 -0.492 . . . . 64.030000000000001 110.897 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -86.64 132.86 33.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.159 -0.473 . . . . 74.430000000000007 110.904 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.01 98.61 7.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 62.130000000000003 110.873 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.13 159.45 1.25 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.426 . . . . 60.149999999999999 111.096 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -116.4 -23.93 8.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 52.109999999999999 110.895 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.5 mmm-85 -141.14 -177.51 5.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 74.319999999999993 110.86 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -58.18 -46.08 86.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 65.140000000000001 110.875 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -52.32 -52.65 51.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 74.25 110.844 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.9 mp0 -67.01 151.16 48.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 50.43 110.872 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.0 tp -125.87 151.71 46.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.155 -0.475 . . . . 75.230000000000004 110.886 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -95.13 142.25 27.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 54.32 110.867 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.736 HG21 HD11 ' A' ' 26' ' ' LEU . 14.6 p -152.45 150.14 13.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.18 -0.464 . . . . 74.129999999999995 111.128 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.3 m -105.96 159.64 28.94 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.682 0.753 . . . . 73.230000000000004 110.84 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.68 121.82 8.52 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.732 2.288 . . . . 62.399999999999999 112.363 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.13 1.77 31.58 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.68 -0.771 . . . . 71.109999999999999 112.483 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -92.14 156.96 16.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.855 0.359 . . . . 60.520000000000003 110.869 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -100.88 131.69 46.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.48 . . . . 72.409999999999997 110.921 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.736 HD11 HG21 ' A' ' 20' ' ' VAL . 4.7 mp -130.83 146.27 52.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.207 -0.451 . . . . 70.140000000000001 110.896 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.14 115.97 31.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 72.120000000000005 110.876 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.924 HD11 ' HB2' ' A' ' 4' ' ' ALA . 43.9 mt -80.8 150.46 4.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 74.120000000000005 111.12 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 24.7 m -123.93 -41.7 2.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 55.43 110.868 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -154.63 -178.42 7.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 54.32 111.124 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.619 ' O ' HG23 ' A' ' 89' ' ' VAL . 1.8 p80 -134.62 175.25 9.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 73.450000000000003 110.858 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.466 ' OH ' HG23 ' B' ' -6' ' ' ILE . 33.4 t80 -137.39 100.29 4.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.233 -0.44 . . . . 73.540000000000006 110.929 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 55.58 25.63 8.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.098 -0.501 . . . . 74.0 110.886 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.57 ' HD2' HD12 ' A' ' 81' ' ' ILE . 35.0 m-85 63.61 16.4 9.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 73.129999999999995 110.935 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.627 ' O ' HG23 ' A' ' 52' ' ' VAL . 10.0 mm-40 -104.03 -54.89 2.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.123 -0.489 . . . . 54.25 110.886 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 39.1 m95 -105.65 151.7 24.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.156 -0.475 . . . . 75.140000000000001 110.935 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.8 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -124.75 135.89 53.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 62.240000000000002 110.874 -179.958 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.7 mm -93.13 95.98 5.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 71.439999999999998 111.136 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.547 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -113.79 153.96 28.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 71.099999999999994 111.109 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 ptmt -126.73 157.6 70.76 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.568 0.699 . . . . 64.120000000000005 110.882 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 130.92 20.22 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.666 2.244 . . . . 75.329999999999998 112.346 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 76.9 mt . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.427 . . . . 62.340000000000003 111.11 179.925 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo . . . . . 0 C--O 1.23 0.117 0 CA-C-O 120.859 0.275 . . . . 73.230000000000004 112.304 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -116.11 -122.46 3.44 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.728 -0.749 . . . . 23.129999999999999 112.471 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -153.69 124.79 7.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.837 0.351 . . . . 41.439999999999998 110.932 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.0 p -134.87 132.76 20.6 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.646 0.736 . . . . 72.200000000000003 111.152 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.474 ' O ' HG22 ' A' ' 55' ' ' VAL . 54.0 Cg_endo -69.7 150.49 68.67 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.711 2.274 . . . . 74.420000000000002 112.381 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.8 HG22 ' CD2' ' A' ' 37' ' ' PHE . 52.9 t -58.17 -22.6 19.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 75.510000000000005 111.134 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -77.93 -3.89 44.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 74.0 110.829 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.639 ' O ' HG22 ' A' ' 6' ' ' THR . 14.9 m-85 -122.25 18.6 10.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.465 . . . . 73.230000000000004 110.935 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.474 HG22 ' O ' ' A' ' 51' ' ' PRO . 3.8 m -153.92 140.07 11.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 71.319999999999993 111.097 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.76 ' HB2' HD11 ' A' ' 7' ' ' LEU . 20.2 ttm180 -112.87 117.01 30.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 71.510000000000005 110.861 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 31.3 mm -66.84 109.18 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.206 -0.452 . . . . 74.5 111.129 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.566 HG23 ' HG2' ' A' ' 56' ' ' ARG . 3.5 pt -130.91 170.09 20.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 74.409999999999997 111.18 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -114.41 141.24 47.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.197 -0.456 . . . . 62.039999999999999 110.846 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.29 -24.99 66.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 63.219999999999999 110.92 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.85 -28.98 17.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 74.129999999999995 110.87 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -148.73 73.6 10.47 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.59 0.709 . . . . 53.140000000000001 110.839 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.586 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.2 Cg_endo -69.79 -10.87 29.59 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.709 2.273 . . . . 70.409999999999997 112.331 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.69 -12.67 33.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 72.409999999999997 111.095 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.6 ttmm -74.44 -52.06 13.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.459 . . . . 74.150000000000006 110.905 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.533 ' HA ' HG23 ' A' ' 69' ' ' VAL . 73.4 m-85 -98.38 23.11 8.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 71.140000000000001 110.926 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.586 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -81.43 -21.97 38.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.108 -0.497 . . . . 65.409999999999997 111.08 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.2 t -96.96 -12.68 23.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 65.200000000000003 110.829 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.533 HG23 ' HA ' ' A' ' 66' ' ' TYR . 55.4 t -51.44 141.73 4.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 63.020000000000003 111.157 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -91.35 76.13 5.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.173 -0.467 . . . . 71.140000000000001 110.875 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.577 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -47.51 -34.91 8.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.185 -0.462 . . . . 64.209999999999994 111.143 -179.864 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -60.17 -44.24 95.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 71.129999999999995 110.953 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -63.87 113.47 3.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.088 -0.506 . . . . 73.439999999999998 110.886 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.06 -24.13 37.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 73.439999999999998 110.866 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -66.3 -57.4 7.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 64.510000000000005 110.895 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.61 -56.07 26.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 65.349999999999994 110.913 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -53.41 -31.32 18.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 71.420000000000002 111.128 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 7.8 mtm -68.35 -55.54 11.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.484 . . . . 73.439999999999998 110.863 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 48.2 mttt -54.53 -39.04 67.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.262 -0.426 . . . . 71.150000000000006 110.894 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.479 HD11 HG11 ' A' ' 69' ' ' VAL . 70.4 mt -65.71 -58.22 7.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 65.099999999999994 111.079 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.731 HG23 ' HB ' ' A' ' 86' ' ' ILE . 97.8 mt -57.79 -35.17 50.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 72.299999999999997 111.127 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -70.77 -52.01 23.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.153 -0.476 . . . . 44.450000000000003 110.836 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -61.28 -49.4 77.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 74.310000000000002 110.892 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -68.9 -14.5 63.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 74.510000000000005 110.881 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.65 55.57 4.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 72.150000000000006 110.902 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.731 ' HB ' HG23 ' A' ' 81' ' ' ILE . 39.0 mt -84.9 132.07 47.11 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 121.671 0.748 . . . . 63.450000000000003 111.16 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 151.33 68.78 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.634 2.223 . . . . 74.200000000000003 112.389 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -85.55 168.29 14.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.43 . . . . 73.150000000000006 111.167 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.619 HG23 ' O ' ' A' ' 31' ' ' HIS . 71.1 t -51.66 -58.12 2.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 63.039999999999999 111.108 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -52.02 -51.65 55.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 71.120000000000005 110.874 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 40.1 mm-40 -57.02 -41.07 77.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.156 -0.475 . . . . 45.399999999999999 110.878 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.446 ' O ' HG23 ' A' ' 96' ' ' THR . 34.8 t90 -66.93 -38.02 85.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.251 -0.431 . . . . 73.219999999999999 110.932 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -68.12 -35.47 78.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 73.439999999999998 110.926 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -71.79 -49.85 35.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 61.539999999999999 110.912 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.407 ' HG2' ' HA ' ' A' ' 92' ' ' TRP . 21.0 pt20 -61.03 -39.93 91.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 63.420000000000002 110.891 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.446 HG23 ' O ' ' A' ' 92' ' ' TRP . 38.8 p . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 52.539999999999999 111.157 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.863 0.363 . . . . 72.349999999999994 110.863 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' -6' ' ' ILE . . . . . 0.466 HG23 ' OH ' ' A' ' 32' ' ' TYR . 3.0 mp -78.26 116.47 59.28 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.608 0.718 . . . . 73.420000000000002 111.141 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 -49.58 0.55 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.679 2.253 . . . . 64.400000000000006 112.366 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 1.2 t 49.61 32.36 4.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.46 . . . . 72.310000000000002 110.877 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -116.31 162.56 25.69 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.598 0.713 . . . . 74.219999999999999 110.872 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.68 -18.19 37.5 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.714 2.276 . . . . 73.109999999999999 112.355 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 65.92 146.15 0.1 OUTLIER Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.593 0.711 . . . . 70.129999999999995 111.08 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.79 153.49 68.72 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.674 2.249 . . . . 63.310000000000002 112.362 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 5.2 mtmp? -100.4 161.17 24.92 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.598 0.713 . . . . 60.299999999999997 110.894 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 165.31 31.38 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.664 2.243 . . . . 63.32 112.356 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--N 1.341 0.14 0 C-N-CA 122.678 2.252 . . . . 73.450000000000003 112.321 179.972 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.631 HD11 HD12 ' A' ' 28' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.816 0.341 . . . . 72.530000000000001 110.939 . . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -130.15 150.65 51.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 72.450000000000003 110.866 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -135.04 144.86 47.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.154 -0.476 . . . . 41.140000000000001 111.102 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.67 HG23 ' O ' ' A' ' 24' ' ' GLU . 10.0 p -114.58 129.38 70.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 75.109999999999999 111.131 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.652 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -69.17 132.3 46.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.47 . . . . 50.329999999999998 111.119 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.753 HD11 ' HB2' ' A' ' 56' ' ' ARG . 3.8 mt -100.73 -20.94 15.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 74.219999999999999 110.918 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -129.25 168.62 15.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.472 . . . . 71.030000000000001 110.942 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -88.91 104.89 17.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.479 . . . . 73.219999999999999 110.899 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.409 ' HB3' HG12 ' A' ' 20' ' ' VAL . 16.7 t80 -91.46 104.42 16.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 72.040000000000006 110.886 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.6 mmtp -84.96 106.44 16.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 71.120000000000005 110.909 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.24 158.74 3.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.225 -0.443 . . . . 41.020000000000003 111.116 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -128.49 -39.2 1.68 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.23 -0.441 . . . . 62.229999999999997 110.863 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 16.0 mmm180 -108.28 178.86 4.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 74.239999999999995 110.854 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -67.27 -36.38 81.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.193 -0.458 . . . . 63.530000000000001 110.833 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -68.76 -49.14 61.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 73.150000000000006 110.903 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -57.04 135.45 56.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.22 -0.445 . . . . 63.450000000000003 110.88 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 18' ' ' LEU . 11.0 tp -112.13 129.77 56.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 62.329999999999998 110.91 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.01 142.1 45.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 74.299999999999997 110.846 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.783 HG21 HD11 ' A' ' 26' ' ' LEU . 6.4 p -152.82 144.61 15.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.198 -0.456 . . . . 62.219999999999999 111.135 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.3 m -105.47 160.52 25.77 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.668 0.746 . . . . 63.240000000000002 110.89 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 122.23 8.92 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.694 2.263 . . . . 72.439999999999998 112.38 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.09 5.53 30.53 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.765 -0.731 . . . . 70.120000000000005 112.473 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.67 ' O ' HG23 ' A' ' 5' ' ' VAL . 13.8 mt-10 -92.3 161.08 14.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.82 0.343 . . . . 74.430000000000007 110.91 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -107.83 127.03 53.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.195 -0.457 . . . . 75.219999999999999 110.894 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.783 HD11 HG21 ' A' ' 20' ' ' VAL . 2.1 mt -129.7 146.5 51.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 74.420000000000002 110.919 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.7 t -104.86 112.54 25.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 60.140000000000001 110.887 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.798 HG12 ' HB2' ' A' ' 39' ' ' ALA . 58.1 mt -81.92 145.41 8.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.128 -0.487 . . . . 73.099999999999994 111.147 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 80.8 m -117.27 -33.41 4.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 43.140000000000001 110.869 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -161.04 173.57 15.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 41.140000000000001 111.102 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.426 ' ND1' HD13 ' A' ' 81' ' ' ILE . 1.5 p80 -122.84 177.95 5.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 73.209999999999994 110.845 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -141.94 99.95 3.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 74.430000000000007 110.934 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.3 t0 54.61 22.82 4.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.087 -0.506 . . . . 74.450000000000003 110.911 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.625 ' HD2' HD12 ' A' ' 81' ' ' ILE . 37.1 m-85 63.74 15.42 8.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 63.240000000000002 110.925 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -103.46 -40.89 6.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.07 -0.514 . . . . 65.0 110.897 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.418 ' CZ2' ' HB2' ' B' ' -3' ' ' ARG . 91.1 m95 -122.24 164.22 18.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.194 -0.457 . . . . 74.540000000000006 110.902 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.755 ' CD2' HG22 ' A' ' 52' ' ' VAL . 1.3 m-85 -134.63 130.5 36.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 74.310000000000002 110.857 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.562 HG13 HG22 ' A' ' 89' ' ' VAL . 8.5 mm -92.39 94.29 4.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 65.450000000000003 111.146 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.798 ' HB2' HG12 ' A' ' 28' ' ' ILE . . . -124.59 164.49 19.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.191 -0.459 . . . . 71.540000000000006 111.099 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.9 pttm -127.43 157.25 73.42 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.521 0.677 . . . . 64.319999999999993 110.926 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 138.12 37.2 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.683 2.256 . . . . 72.239999999999995 112.32 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 60.5 mt . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 73.430000000000007 111.15 179.852 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 N--CA 1.466 -0.096 0 CA-C-O 120.871 0.279 . . . . 63.009999999999998 112.363 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -115.83 -130.71 4.72 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.702 -0.761 . . . . 73.239999999999995 112.487 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -144.18 127.05 16.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.861 0.363 . . . . 71.319999999999993 110.913 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.2 p -135.13 129.85 19.09 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.672 0.749 . . . . 74.349999999999994 111.135 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.68 161.72 44.82 Favored 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.677 2.251 . . . . 65.200000000000003 112.346 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.755 HG22 ' CD2' ' A' ' 37' ' ' PHE . 4.0 t -83.06 -21.74 8.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.238 -0.437 . . . . 71.530000000000001 111.139 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.2 m -75.98 -4.7 42.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.124 -0.489 . . . . 74.25 110.888 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -126.16 -0.82 7.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.128 -0.487 . . . . 65.420000000000002 110.939 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -125.37 147.87 29.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.144 -0.48 . . . . 73.140000000000001 111.133 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.753 ' HB2' HD11 ' A' ' 7' ' ' LEU . 15.7 ttp180 -123.63 110.6 15.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 73.430000000000007 110.814 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.406 ' O ' HG22 ' A' ' 57' ' ' ILE . 1.7 mp -65.76 111.44 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 74.450000000000003 111.146 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.654 HG23 ' HG2' ' A' ' 56' ' ' ARG . 3.5 pt -127.64 141.69 45.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 71.420000000000002 111.107 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -70.43 123.83 22.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 74.329999999999998 110.895 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.0 tp -56.35 -24.93 47.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 74.310000000000002 110.92 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.01 -29.38 16.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 64.349999999999994 110.878 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -143.09 78.49 15.14 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.618 0.723 . . . . 75.340000000000003 110.841 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.748 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.9 Cg_endo -69.76 -7.36 20.85 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.668 2.245 . . . . 73.310000000000002 112.339 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.11 -7.58 38.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.435 . . . . 74.5 111.047 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -84.4 -52.22 6.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.3 -0.409 . . . . 73.310000000000002 110.863 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.648 ' O ' HG12 ' A' ' 69' ' ' VAL . 12.9 m-85 -97.48 23.88 7.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 73.049999999999997 110.914 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.748 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -85.41 -19.2 31.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 74.040000000000006 111.118 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 90.4 p -92.58 -24.13 18.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.237 -0.438 . . . . 65.420000000000002 110.859 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 1.054 HG21 HD11 ' A' ' 80' ' ' ILE . 9.0 p -52.07 155.56 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.477 . . . . 74.0 111.14 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -110.61 94.98 5.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.195 -0.457 . . . . 75.030000000000001 110.871 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.742 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -58.44 -38.64 77.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.175 -0.466 . . . . 61.200000000000003 111.119 -179.867 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -55.1 -44.26 74.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.252 -0.431 . . . . 75.129999999999995 110.917 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -63.74 110.04 1.91 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.134 -0.485 . . . . 52.520000000000003 110.88 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.57 -28.69 21.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 62.530000000000001 110.878 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -66.97 -56.74 8.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 72.140000000000001 110.892 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -58.64 -55.15 38.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 74.109999999999999 110.89 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.55 ' HA ' HD12 ' A' ' 80' ' ' ILE . 5.5 p -53.92 -33.22 23.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 75.230000000000004 111.09 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 14.5 mtm -67.14 -53.5 30.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.231 -0.44 . . . . 72.230000000000004 110.834 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.1 mttm -56.18 -37.4 69.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 55.520000000000003 110.925 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 1.054 HD11 HG21 ' A' ' 69' ' ' VAL . 17.3 mt -66.77 -52.62 43.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 74.299999999999997 111.102 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.744 HG23 ' HB ' ' A' ' 86' ' ' ILE . 90.6 mt -63.25 -33.86 63.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 62.219999999999999 111.096 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -71.11 -46.2 62.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 71.0 110.885 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -68.53 -48.43 64.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.465 . . . . 63.009999999999998 110.844 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -68.75 -15.35 63.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.134 -0.485 . . . . 73.150000000000006 110.839 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt 59.95 49.56 7.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.147 -0.479 . . . . 52.140000000000001 110.884 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.744 ' HB ' HG23 ' A' ' 81' ' ' ILE . 24.5 mt -78.23 131.53 68.94 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.598 0.714 . . . . 71.540000000000006 111.177 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 164.32 34.97 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.701 2.268 . . . . 72.349999999999994 112.307 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -95.41 170.2 9.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.2 -0.455 . . . . 75.530000000000001 111.19 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.562 HG22 HG13 ' A' ' 38' ' ' ILE . 68.6 t -55.81 -54.65 24.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.272 -0.422 . . . . 63.049999999999997 111.122 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -51.95 -50.58 60.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 60.130000000000003 110.893 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -57.74 -44.39 86.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.489 . . . . 73.219999999999999 110.894 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 23.0 t90 -61.68 -43.0 99.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.208 -0.451 . . . . 73.209999999999994 110.921 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 5.1 mmpt? -60.65 -53.25 59.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 65.219999999999999 110.884 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -59.98 -37.82 80.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 74.349999999999994 110.904 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -61.06 -53.03 62.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.481 . . . . 73.209999999999994 110.904 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 53.119999999999997 111.15 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.826 0.346 . . . . 71.299999999999997 110.948 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 26.8 mm 53.06 76.31 0.54 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.653 0.739 . . . . 65.140000000000001 111.163 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.67 78.42 0.98 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.704 2.269 . . . . 63.32 112.386 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 14.5 t -81.13 -0.52 40.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 54.310000000000002 110.824 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' -3' ' ' ARG . . . . . 0.418 ' HB2' ' CZ2' ' A' ' 36' ' ' TRP . 24.5 mmt180 -48.91 161.21 0.43 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.575 0.702 . . . . 74.230000000000004 110.874 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 -26.21 27.62 Favored 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.677 2.251 . . . . 64.109999999999999 112.344 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.29 85.84 0.15 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.591 0.71 . . . . 72.349999999999994 111.08 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 158.38 57.09 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.622 2.215 . . . . 75.530000000000001 112.367 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.94 160.45 33.79 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.582 0.706 . . . . 75.120000000000005 110.894 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 167.48 24.34 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.674 2.25 . . . . 74.519999999999996 112.345 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--N 1.342 0.195 0 C-N-CA 122.645 2.23 . . . . 62.109999999999999 112.37 179.95 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.697 HD11 HG13 ' A' ' 28' ' ' ILE . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.846 0.355 . . . . 74.0 110.937 . . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -123.26 142.84 50.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.466 . . . . 70.329999999999998 110.875 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -122.76 150.49 42.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 70.420000000000002 111.057 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.1 p -116.07 129.08 73.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.176 -0.465 . . . . 65.200000000000003 111.127 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.707 HG21 ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -68.39 132.46 47.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.453 . . . . 63.439999999999998 111.153 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.779 HD11 ' HB2' ' A' ' 56' ' ' ARG . 7.1 mt -102.71 -16.81 15.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.208 -0.451 . . . . 64.420000000000002 110.909 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -136.49 161.99 34.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.474 . . . . 64.450000000000003 110.924 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -86.87 114.26 23.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.086 -0.506 . . . . 61.520000000000003 110.865 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -100.2 130.08 46.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.115 -0.493 . . . . 73.230000000000004 110.88 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -104.21 109.36 21.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.12 -0.491 . . . . 65.109999999999999 110.913 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.478 ' HB1' ' HB3' ' A' ' 17' ' ' GLU . . . -62.86 159.58 16.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 71.310000000000002 111.114 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -116.57 -28.44 6.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 74.239999999999995 110.89 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -141.46 -174.52 4.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 74.299999999999997 110.846 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -64.71 -39.19 93.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.172 -0.467 . . . . 73.430000000000007 110.824 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -62.86 -18.4 62.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.222 -0.445 . . . . 71.209999999999994 110.85 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.478 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 0.4 OUTLIER -110.2 140.12 44.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 73.329999999999998 110.912 -179.904 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 18' ' ' LEU . . . . . 0.434 ' C ' ' HB2' ' A' ' 12' ' ' ALA . 4.6 tp -114.57 153.77 29.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 74.439999999999998 110.898 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -97.78 126.77 43.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.476 . . . . 62.340000000000003 110.864 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.707 ' HB ' HG21 ' A' ' 6' ' ' THR . 0.2 OUTLIER -125.51 159.29 33.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.246 -0.433 . . . . 72.209999999999994 111.16 179.955 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.4 m -124.27 159.25 58.01 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.654 0.74 . . . . 45.439999999999998 110.799 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 118.48 5.71 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.656 2.238 . . . . 73.219999999999999 112.329 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.02 -0.34 31.6 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.758 -0.734 . . . . 63.25 112.504 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -89.25 151.37 22.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.863 0.363 . . . . 74.439999999999998 110.888 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.568 ' CB ' HD12 ' A' ' 42' ' ' ILE . 10.5 m120 -96.61 112.63 24.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.136 -0.483 . . . . 65.430000000000007 110.881 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.754 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 3.1 mm? -112.25 142.04 45.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.193 -0.458 . . . . 64.209999999999994 110.905 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.72 112.48 24.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 60.439999999999998 110.85 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.697 HG13 HD11 ' A' ' 2' ' ' LEU . 31.3 mm -66.94 144.89 14.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 71.420000000000002 111.117 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.5 m -122.46 -42.09 2.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.169 -0.469 . . . . 62.140000000000001 110.904 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.409 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -171.77 168.97 6.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 62.539999999999999 111.117 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.442 ' CE1' HG21 ' A' ' 81' ' ' ILE . 2.1 p80 -119.45 178.31 4.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 65.430000000000007 110.861 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -148.69 105.7 3.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 65.140000000000001 110.854 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 56.54 22.52 6.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.084 -0.507 . . . . 74.310000000000002 110.866 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.614 ' HD2' HD12 ' A' ' 81' ' ' ILE . 16.5 m-85 57.78 22.78 8.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 72.540000000000006 110.939 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -121.06 -5.47 9.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.119 -0.491 . . . . 70.230000000000004 110.935 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.555 ' HB3' HD11 ' A' ' 49' ' ' LEU . 98.7 m95 -152.51 158.8 43.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.11 -0.495 . . . . 74.109999999999999 110.89 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.601 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.5 OUTLIER -141.55 151.67 43.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.458 . . . . 71.120000000000005 110.888 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.42 ' CD1' HD22 ' A' ' 49' ' ' LEU . 6.3 mm -109.49 94.03 2.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.191 -0.459 . . . . 71.120000000000005 111.121 179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.754 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -107.25 146.03 31.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 75.239999999999995 111.159 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -118.0 155.56 51.07 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.584 0.706 . . . . 64.519999999999996 110.93 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 123.7 10.35 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.66 2.24 . . . . 73.219999999999999 112.329 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.568 HD12 ' CB ' ' A' ' 25' ' ' ASN . 69.5 mt . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 70.239999999999995 111.123 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 N--CA 1.465 -0.164 0 CA-C-O 120.831 0.263 . . . . 54.009999999999998 112.365 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -129.71 -146.44 6.04 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.739 -0.743 . . . . 53.219999999999999 112.477 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.555 HD11 ' HB3' ' A' ' 36' ' ' TRP . 0.1 OUTLIER -137.04 124.75 22.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.828 0.347 . . . . 64.129999999999995 110.889 -179.932 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.424 ' N ' HD13 ' A' ' 49' ' ' LEU . 14.5 p -134.26 132.25 21.0 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.636 0.731 . . . . 71.329999999999998 111.109 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.665 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.6 Cg_endo -69.8 158.36 57.19 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.677 2.251 . . . . 53.5 112.328 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.922 HG11 HG21 ' A' ' 77' ' ' VAL . 2.7 t -76.3 -20.86 15.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 75.409999999999997 111.128 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.4 m -79.71 0.95 28.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 73.439999999999998 110.856 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.407 ' HB2' ' HG2' ' A' ' 51' ' ' PRO . 7.5 m-85 -118.75 -27.13 5.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.145 -0.48 . . . . 75.409999999999997 110.959 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.665 HG22 ' O ' ' A' ' 51' ' ' PRO . 13.1 m -106.23 147.9 11.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.081 -0.508 . . . . 43.439999999999998 111.123 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.779 ' HB2' HD11 ' A' ' 7' ' ' LEU . 15.4 ttp180 -117.66 110.9 18.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 55.200000000000003 110.874 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.42 ' O ' HG22 ' A' ' 57' ' ' ILE . 1.6 mp -68.76 112.39 3.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 53.399999999999999 111.125 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.66 HG23 ' HG2' ' A' ' 56' ' ' ARG . 7.1 pt -125.22 167.16 19.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.455 . . . . 74.25 111.171 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -102.42 125.39 49.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 62.210000000000001 110.895 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.3 mt -56.22 -24.7 43.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 63.240000000000002 110.951 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.75 -29.92 18.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.15 -0.477 . . . . 73.140000000000001 110.856 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -145.92 74.74 13.27 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.596 0.712 . . . . 63.439999999999998 110.898 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.669 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.4 Cg_endo -69.76 -8.83 24.61 Favored 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.711 2.274 . . . . 73.409999999999997 112.359 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.96 -5.9 36.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 54.43 111.078 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.2 ttmm -84.1 -51.97 6.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 73.340000000000003 110.884 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -90.67 -0.08 57.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.444 . . . . 75.519999999999996 110.895 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.669 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -61.3 -17.86 55.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 62.030000000000001 111.12 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 86.2 p -76.62 -24.16 53.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.25 -0.432 . . . . 52.530000000000001 110.817 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.7 HG12 ' H ' ' A' ' 71' ' ' THR . 14.2 t -77.77 121.76 31.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 74.239999999999995 111.11 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -90.25 11.68 20.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 65.349999999999994 110.835 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.858 ' HB ' HG12 ' A' ' 52' ' ' VAL . 2.0 p 45.91 33.7 1.69 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.471 . . . . 75.519999999999996 111.163 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -104.12 -54.83 2.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 73.049999999999997 110.951 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.86 115.44 4.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 75.019999999999996 110.812 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.04 -28.99 19.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.457 . . . . 73.030000000000001 110.896 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -66.61 -49.04 67.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 74.0 110.909 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -62.95 -57.0 12.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 74.510000000000005 110.961 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.922 HG21 HG11 ' A' ' 52' ' ' VAL . 1.7 p -54.31 -31.7 22.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 63.140000000000001 111.162 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 11.5 mtm -67.91 -54.11 21.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.492 . . . . 63.439999999999998 110.844 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 34.8 mttt -57.55 -35.79 70.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 73.349999999999994 110.901 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.516 HD11 HG11 ' A' ' 69' ' ' VAL . 41.8 mt -67.71 -50.47 60.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 71.140000000000001 111.118 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.725 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.4 mt -65.64 -35.7 75.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 65.409999999999997 111.084 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -71.21 -52.05 21.24 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 72.299999999999997 110.886 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -58.57 -52.69 64.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.185 -0.461 . . . . 73.319999999999993 110.923 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -67.95 -15.51 63.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 72.099999999999994 110.885 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.8 mmtm 60.94 54.98 3.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.486 . . . . 53.420000000000002 110.942 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.725 ' HB ' HG23 ' A' ' 81' ' ' ILE . 21.2 mt -82.25 131.3 56.52 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.622 0.725 . . . . 63.109999999999999 111.129 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.409 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 54.5 Cg_endo -69.72 162.81 40.59 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.654 2.236 . . . . 73.230000000000004 112.346 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.19 171.48 7.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.196 -0.456 . . . . 64.040000000000006 111.13 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 85.8 t -51.94 -53.98 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 61.409999999999997 111.148 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 69.2 mt-10 -51.68 -51.99 51.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 73.519999999999996 110.853 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 60.4 mm-40 -59.21 -43.88 92.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.446 . . . . 44.420000000000002 110.939 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 32.9 t90 -62.61 -38.75 91.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 71.510000000000005 110.893 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 5.8 mmpt? -64.95 -52.8 54.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 63.32 110.867 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.23 -41.92 85.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.234 -0.439 . . . . 71.310000000000002 110.879 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -63.09 -46.44 87.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.225 -0.443 . . . . 65.450000000000003 110.947 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.1 p . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.451 . . . . 71.310000000000002 111.152 -179.925 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.782 0.325 . . . . 64.310000000000002 110.857 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 22.0 mm 56.48 77.88 0.4 Allowed Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.663 0.744 . . . . 63.229999999999997 111.16 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.82 86.9 0.57 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.635 2.223 . . . . 73.25 112.365 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 13.2 t -80.4 -1.39 41.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.456 . . . . 75.530000000000001 110.862 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' -3' ' ' ARG . . . . . 0.406 ' HB2' ' CZ2' ' A' ' 36' ' ' TRP . 0.0 OUTLIER -49.92 163.2 0.43 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.628 0.727 . . . . 74.25 110.85 -179.96 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 -22.64 31.87 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.686 2.258 . . . . 74.340000000000003 112.385 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.63 84.07 0.19 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.577 0.703 . . . . 74.200000000000003 111.135 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 163.24 38.97 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.721 2.28 . . . . 74.310000000000002 112.368 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -100.14 160.47 27.02 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.601 0.715 . . . . 62.229999999999997 110.879 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 163.84 36.77 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.691 2.261 . . . . 51.409999999999997 112.339 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 C--N 1.341 0.148 0 C-N-CA 122.702 2.268 . . . . 61.130000000000003 112.319 179.94 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.891 0.376 . . . . 74.030000000000001 110.913 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.724 ' CE1' HD12 ' A' ' 60' ' ' LEU . 12.7 m-85 -116.8 163.9 15.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.469 . . . . 65.099999999999994 110.93 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -142.91 164.02 31.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 72.219999999999999 111.099 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 24' ' ' GLU . 10.9 p -130.71 130.89 64.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 61.020000000000003 111.143 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.606 HG21 ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -72.86 139.6 47.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 74.439999999999998 111.09 -179.931 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.683 HD11 ' HB2' ' A' ' 56' ' ' ARG . 23.3 mt -114.07 -11.22 12.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 64.319999999999993 110.915 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -137.01 159.63 41.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 71.310000000000002 110.892 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -85.74 108.85 18.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 75.530000000000001 110.871 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -93.63 139.28 30.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 75.25 110.855 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -112.97 97.1 6.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.118 -0.492 . . . . 54.43 110.927 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.67 157.36 1.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.451 . . . . 72.120000000000005 111.108 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -115.82 -32.97 5.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 70.400000000000006 110.894 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -133.11 -178.45 4.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 72.319999999999993 110.886 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -63.47 -41.34 98.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.207 -0.451 . . . . 71.109999999999999 110.832 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -57.32 -23.68 50.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.211 -0.45 . . . . 63.030000000000001 110.901 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.0 152.23 19.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 55.130000000000003 110.908 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.2 tt -131.77 120.55 22.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.138 -0.483 . . . . 64.340000000000003 110.945 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -63.73 143.62 57.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.235 -0.439 . . . . 74.540000000000006 110.836 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.606 ' HB ' HG21 ' A' ' 6' ' ' THR . 0.9 OUTLIER -139.95 159.11 26.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 72.329999999999998 111.144 -179.984 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.3 m -121.44 158.07 54.57 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.671 0.748 . . . . 73.209999999999994 110.861 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.72 117.96 5.39 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.709 2.273 . . . . 74.329999999999998 112.375 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.06 4.66 31.14 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.737 -0.744 . . . . 55.039999999999999 112.448 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.531 ' O ' HG23 ' A' ' 5' ' ' VAL . 39.5 mm-40 -92.12 154.59 18.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.85 0.357 . . . . 74.439999999999998 110.869 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -105.61 115.82 30.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 63.340000000000003 110.92 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.731 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 3.7 mp -116.55 155.35 28.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.201 -0.454 . . . . 62.450000000000003 110.938 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.5 t -108.26 112.79 25.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 73.040000000000006 110.895 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 57.4 mt -75.72 144.86 11.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 64.0 111.146 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.8 m -116.23 -43.94 2.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.144 -0.48 . . . . 72.409999999999997 110.924 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.52 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -161.02 174.8 13.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 54.310000000000002 111.115 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.439 ' CE1' HG21 ' A' ' 81' ' ' ILE . 3.3 p80 -121.18 177.95 4.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 75.519999999999996 110.829 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.431 ' HB3' ' HB2' ' A' ' 36' ' ' TRP . 20.2 t80 -146.87 100.83 3.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.206 -0.452 . . . . 71.420000000000002 110.91 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.416 ' HB3' ' HG2' ' A' ' 35' ' ' GLU . 33.6 t0 59.97 17.5 6.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.098 -0.501 . . . . 64.219999999999999 110.905 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.575 ' HD2' HD12 ' A' ' 81' ' ' ILE . 41.3 m-85 63.47 29.65 15.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.169 -0.469 . . . . 72.299999999999997 110.939 -179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.416 ' HG2' ' HB3' ' A' ' 33' ' ' ASP . 4.4 pt-20 -131.16 -1.76 4.02 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.101 -0.499 . . . . 64.540000000000006 110.921 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.448 ' HB3' HD21 ' A' ' 49' ' ' LEU . 88.1 m95 -152.73 135.52 15.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.107 -0.497 . . . . 74.140000000000001 110.905 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.581 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.5 OUTLIER -121.78 131.38 54.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.259 -0.428 . . . . 75.120000000000005 110.871 -179.951 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.4 mm -87.04 94.55 4.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 71.349999999999994 111.154 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.731 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -111.1 138.99 46.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 74.430000000000007 111.106 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 51.2 pttt -112.82 153.67 45.07 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.55 0.69 . . . . 72.319999999999993 110.903 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 119.56 6.49 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.664 2.243 . . . . 65.299999999999997 112.394 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.4 mt . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 72.239999999999995 111.16 179.911 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo . . . . . 0 C--O 1.23 0.113 0 CA-C-O 120.803 0.251 . . . . 73.439999999999998 112.348 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -105.6 -106.47 3.12 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.752 -0.737 . . . . 72.510000000000005 112.455 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.448 HD21 ' HB3' ' A' ' 36' ' ' TRP . 1.3 tt -163.55 124.73 2.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.837 0.351 . . . . 72.25 110.935 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.453 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.3 p -137.56 133.8 18.15 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.658 0.742 . . . . 72.230000000000004 111.074 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.453 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.9 Cg_endo -69.78 153.85 68.36 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.661 2.241 . . . . 75.019999999999996 112.355 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.822 HG12 ' HB ' ' A' ' 71' ' ' THR . 4.9 t -72.59 -21.01 19.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 64.319999999999993 111.148 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.0 m -77.0 -2.58 34.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 71.109999999999999 110.837 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.441 ' O ' HG22 ' A' ' 6' ' ' THR . 37.7 m-85 -127.22 22.8 6.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.107 -0.497 . . . . 64.299999999999997 110.881 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.616 HG22 ' HA ' ' A' ' 52' ' ' VAL . 10.7 m -148.63 163.23 5.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.119 -0.491 . . . . 72.219999999999999 111.155 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.686 ' HG2' HG23 ' A' ' 58' ' ' ILE . 26.1 ttm180 -130.57 119.09 21.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.461 . . . . 73.430000000000007 110.883 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 43.2 mm -70.13 108.8 2.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.456 . . . . 72.540000000000006 111.152 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.686 HG23 ' HG2' ' A' ' 56' ' ' ARG . 1.4 pt -134.18 132.82 55.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 73.120000000000005 111.15 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -67.34 145.77 54.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 63.32 110.868 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.724 HD12 ' CE1' ' A' ' 3' ' ' PHE . 0.4 OUTLIER -71.31 -36.67 71.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 73.120000000000005 110.911 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.24 -24.49 32.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 74.310000000000002 110.898 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -148.76 74.17 10.34 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.607 0.717 . . . . 62.109999999999999 110.904 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.677 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.7 Cg_endo -69.74 -8.57 23.95 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.688 2.259 . . . . 62.43 112.331 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.46 -18.46 23.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 72.549999999999997 111.113 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.8 ttmt -74.62 -50.32 18.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 73.120000000000005 110.921 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.536 ' O ' HG12 ' A' ' 69' ' ' VAL . 65.5 m-85 -95.25 23.27 5.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 75.310000000000002 110.939 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.677 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -89.48 11.71 18.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.13 -0.486 . . . . 53.530000000000001 111.11 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.7 p -114.87 -24.04 8.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 72.519999999999996 110.869 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.536 HG12 ' O ' ' A' ' 66' ' ' TYR . 7.9 p -55.18 140.24 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.145 -0.48 . . . . 54.009999999999998 111.134 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -99.44 93.72 6.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 72.430000000000007 110.887 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.822 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -50.84 -30.15 13.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 70.409999999999997 111.127 -179.884 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -57.38 -51.02 71.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 72.420000000000002 110.876 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -63.99 110.11 2.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.172 -0.467 . . . . 70.319999999999993 110.824 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -24.29 39.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 74.450000000000003 110.865 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -66.87 -52.96 37.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 74.319999999999993 110.858 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.602 ' O ' HD12 ' A' ' 80' ' ' ILE . 1.2 mt-30 -60.15 -58.45 8.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 75.010000000000005 110.943 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.519 HG21 HG11 ' A' ' 52' ' ' VAL . 2.6 p -51.63 -32.27 13.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 73.349999999999994 111.162 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.8 mtm -68.16 -51.73 42.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 70.040000000000006 110.93 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.1 mttm -55.39 -47.07 76.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.209 -0.451 . . . . 74.219999999999999 110.94 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.602 HD12 ' O ' ' A' ' 76' ' ' GLN . 1.7 mp -60.98 -53.73 45.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 71.319999999999993 111.153 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.575 HD12 ' HD2' ' A' ' 34' ' ' TYR . 82.0 mt -57.35 -36.05 51.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.154 -0.476 . . . . 51.539999999999999 111.138 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -71.16 -51.9 22.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 75.510000000000005 110.883 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -59.14 -49.4 78.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.445 . . . . 74.329999999999998 110.924 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -67.9 -15.88 63.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 75.549999999999997 110.868 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 29.6 mmtm 61.31 49.51 5.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 75.430000000000007 110.873 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.565 ' HB ' HG23 ' A' ' 81' ' ' ILE . 38.2 mt -79.14 125.16 84.04 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.598 0.714 . . . . 61.229999999999997 111.158 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.52 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 54.0 Cg_endo -69.68 168.72 20.63 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.699 2.266 . . . . 63.399999999999999 112.342 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.77 167.04 14.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 42.450000000000003 111.125 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.689 HG12 ' CE ' ' A' ' 93' ' ' LYS . 96.2 t -51.04 -58.88 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.205 -0.452 . . . . 74.430000000000007 111.139 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -51.28 -48.04 62.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.481 . . . . 73.049999999999997 110.877 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -56.8 -33.48 66.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.465 . . . . 75.420000000000002 110.886 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 22.3 t90 -66.78 -41.01 88.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.241 -0.436 . . . . 75.010000000000005 110.888 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.689 ' CE ' HG12 ' A' ' 89' ' ' VAL . 16.7 mtmt -67.4 -49.32 64.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 73.239999999999995 110.915 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -61.6 -39.7 92.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 55.140000000000001 110.836 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -65.27 -48.84 71.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 72.510000000000005 110.937 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 3.6 p . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 75.010000000000005 111.141 -179.958 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.823 0.344 . . . . 65.120000000000005 110.898 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 28.8 mm 50.1 78.18 0.42 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.612 0.72 . . . . 70.310000000000002 111.149 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 88.75 0.53 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.689 2.259 . . . . 72.239999999999995 112.356 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 36.8 p -78.6 -2.8 40.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 55.229999999999997 110.839 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' -3' ' ' ARG . . . . . 0.445 ' HB2' ' CZ2' ' A' ' 36' ' ' TRP . 22.3 mmm-85 -49.92 160.53 0.63 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.616 0.722 . . . . 75.540000000000006 110.853 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 -19.27 36.61 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.673 2.249 . . . . 54.43 112.337 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.54 84.29 0.18 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.596 0.712 . . . . 72.010000000000005 111.135 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.66 160.06 51.14 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.717 2.278 . . . . 73.510000000000005 112.365 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.75 160.47 27.8 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.543 0.687 . . . . 54.130000000000003 110.884 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 167.28 24.91 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.658 2.238 . . . . 72.420000000000002 112.338 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo . . . . . 0 C--N 1.342 0.193 0 C-N-CA 122.705 2.27 . . . . 62.310000000000002 112.313 179.984 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.642 HD12 ' HB ' ' A' ' 28' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.833 0.349 . . . . 72.430000000000007 110.899 . . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.462 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 73.9 m-85 -140.89 139.8 34.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 75.219999999999999 110.889 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.698 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -128.22 159.61 34.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.113 -0.494 . . . . 64.340000000000003 111.094 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 24' ' ' GLU . 6.1 p -127.75 120.9 55.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.259 -0.428 . . . . 73.319999999999993 111.166 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.702 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -62.98 128.48 36.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 71.200000000000003 111.143 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.501 HD11 ' HB2' ' A' ' 56' ' ' ARG . 33.9 mt -101.57 -15.54 17.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.225 -0.443 . . . . 64.519999999999996 110.927 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -137.51 157.68 46.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 75.540000000000006 110.948 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -80.08 105.09 11.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.099 -0.5 . . . . 72.400000000000006 110.925 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -93.55 101.08 13.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 61.340000000000003 110.887 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.34 121.54 25.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.474 . . . . 75.5 110.915 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.59 146.84 52.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 71.319999999999993 111.095 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -116.34 -26.63 7.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.238 -0.437 . . . . 75.219999999999999 110.853 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -124.36 178.53 5.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 74.409999999999997 110.862 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -68.8 -26.71 65.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.192 -0.458 . . . . 71.010000000000005 110.849 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -77.36 -31.56 54.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 73.439999999999998 110.898 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -74.36 148.49 41.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 72.420000000000002 110.907 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.7 tp -122.31 134.79 54.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.191 -0.459 . . . . 65.140000000000001 110.906 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -80.41 132.44 35.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.444 . . . . 75.340000000000003 110.852 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.702 ' CG1' HG21 ' A' ' 6' ' ' THR . 9.7 p -146.38 147.05 18.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 71.530000000000001 111.115 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.3 m -107.83 160.27 27.42 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.667 0.746 . . . . 73.200000000000003 110.849 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 125.91 12.68 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.7 2.266 . . . . 74.340000000000003 112.315 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.05 1.5 31.7 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.777 -0.725 . . . . 50.109999999999999 112.523 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.426 ' O ' HG23 ' A' ' 5' ' ' VAL . 6.5 mm-40 -92.23 163.85 13.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.854 0.359 . . . . 64.420000000000002 110.927 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -113.19 122.02 46.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 64.319999999999993 110.879 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.797 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 2.3 mm? -117.1 151.69 36.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 75.0 110.925 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.78 112.58 24.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.469 . . . . 74.239999999999995 110.886 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.698 HD11 ' HB2' ' A' ' 4' ' ' ALA . 68.9 mt -77.88 143.35 12.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.107 -0.497 . . . . 71.439999999999998 111.124 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -118.94 -41.74 2.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.159 -0.473 . . . . 53.5 110.883 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.438 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -158.95 174.17 15.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.231 -0.441 . . . . 72.129999999999995 111.111 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.553 ' ND1' HD13 ' A' ' 81' ' ' ILE . 1.7 p80 -127.71 178.84 5.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.449 . . . . 64.420000000000002 110.869 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -138.34 100.25 4.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 75.319999999999993 110.895 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 45.9 t0 54.98 25.49 6.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 71.099999999999994 110.856 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.624 ' HD2' HD12 ' A' ' 81' ' ' ILE . 24.7 m-85 63.86 16.03 9.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.244 -0.435 . . . . 72.230000000000004 110.927 -179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.567 ' O ' HG23 ' A' ' 52' ' ' VAL . 28.9 mm-40 -103.46 -50.04 3.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 75.349999999999994 110.866 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 81.6 m95 -112.42 164.64 13.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.12 -0.491 . . . . 73.439999999999998 110.923 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.696 ' CD1' HG22 ' A' ' 52' ' ' VAL . 3.3 m-85 -138.23 155.94 48.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 73.540000000000006 110.884 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 11.5 mm -113.94 94.29 3.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.133 -0.485 . . . . 70.010000000000005 111.079 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.797 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -108.28 146.69 32.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 54.130000000000003 111.078 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.3 mttm -115.79 153.91 48.09 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.571 0.701 . . . . 72.420000000000002 110.886 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 118.67 5.82 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.664 2.242 . . . . 61.310000000000002 112.311 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 30.6 mt . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.189 -0.46 . . . . 54.229999999999997 111.149 179.882 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 N--CA 1.466 -0.143 0 CA-C-O 120.825 0.26 . . . . 73.420000000000002 112.329 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -117.86 -131.27 4.44 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.752 -0.737 . . . . 71.239999999999995 112.488 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.4 HD23 ' HD2' ' B' ' -7' ' ' PHE . 0.0 OUTLIER -146.04 128.35 15.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.845 0.355 . . . . 71.109999999999999 110.91 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.7 p -142.98 131.06 11.23 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.616 0.722 . . . . 73.239999999999995 111.146 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.662 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.4 Cg_endo -69.82 163.0 39.96 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.698 2.266 . . . . 75.099999999999994 112.283 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.78 HG12 ' HB ' ' A' ' 71' ' ' THR . 9.6 t -69.88 -21.64 24.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.221 -0.445 . . . . 74.239999999999995 111.155 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.2 m -80.48 -0.23 36.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.145 -0.48 . . . . 74.450000000000003 110.83 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -124.36 12.88 8.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.132 -0.486 . . . . 74.200000000000003 110.945 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.662 HG22 ' O ' ' A' ' 51' ' ' PRO . 10.3 m -152.84 139.27 12.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 73.219999999999999 111.164 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.557 ' HG2' HG23 ' A' ' 58' ' ' ILE . 19.6 ttm180 -112.08 119.74 39.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 73.049999999999997 110.861 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 16.5 mm -66.54 109.29 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 75.150000000000006 111.162 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.557 HG23 ' HG2' ' A' ' 56' ' ' ARG . 1.2 pt -131.6 128.19 60.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.466 . . . . 45.439999999999998 111.157 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.72 126.28 27.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 74.219999999999999 110.89 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.462 HD22 ' CZ ' ' A' ' 3' ' ' PHE . 17.1 tp -58.26 -29.77 66.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 73.400000000000006 110.941 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 9.0 mmt -88.64 -1.45 58.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 74.420000000000002 110.849 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -170.88 82.6 0.53 Allowed Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.602 0.715 . . . . 75.329999999999998 110.909 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.739 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 54.0 Cg_endo -69.72 -7.12 20.23 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.678 2.252 . . . . 74.209999999999994 112.398 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -100.69 -2.64 32.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 71.129999999999995 111.14 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.3 ttpt -81.58 -52.55 7.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 72.439999999999998 110.888 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.554 ' O ' HG12 ' A' ' 69' ' ' VAL . 32.8 m-85 -104.24 23.51 12.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.271 -0.422 . . . . 74.140000000000001 110.934 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.739 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -79.88 -18.24 51.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 72.450000000000003 111.117 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.8 p -106.12 22.85 15.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 63.109999999999999 110.875 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 1.05 HG21 HD11 ' A' ' 80' ' ' ILE . 8.0 p -90.86 149.2 4.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.15 -0.477 . . . . 74.010000000000005 111.165 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -98.61 83.85 3.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 62.350000000000001 110.87 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.78 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.1 OUTLIER -51.25 -44.57 61.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 61.329999999999998 111.113 -179.883 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -54.15 -40.63 67.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 73.129999999999995 110.943 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 61.4 t0 -63.71 107.34 1.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.491 . . . . 73.019999999999996 110.843 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.7 -28.56 22.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 61.229999999999997 110.831 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -66.89 -56.26 11.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 53.450000000000003 110.874 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -59.25 -56.1 26.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 65.430000000000007 110.908 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.5 p -53.14 -32.12 18.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 75.340000000000003 111.135 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 12.2 mtm -67.47 -54.55 19.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 72.439999999999998 110.887 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.6 mttp -55.63 -39.28 70.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.445 . . . . 72.109999999999999 110.906 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 1.05 HD11 HG21 ' A' ' 69' ' ' VAL . 83.3 mt -64.34 -54.9 25.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 71.040000000000006 111.156 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.782 HG23 ' HB ' ' A' ' 86' ' ' ILE . 97.1 mt -59.91 -35.36 60.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 74.420000000000002 111.166 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -69.09 -49.38 57.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.175 -0.466 . . . . 60.43 110.894 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -62.23 -43.57 98.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 73.329999999999998 110.879 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -75.5 -18.23 59.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 71.439999999999998 110.857 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 60.1 mmtt 63.18 49.53 3.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 72.420000000000002 110.904 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.782 ' HB ' HG23 ' A' ' 81' ' ' ILE . 21.1 mt -77.33 129.65 77.02 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.618 0.723 . . . . 64.129999999999995 111.156 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.438 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 54.2 Cg_endo -69.74 163.29 38.8 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.704 2.269 . . . . 74.400000000000006 112.356 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.85 166.17 12.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.248 -0.433 . . . . 72.099999999999994 111.108 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 91.4 t -50.66 -54.58 9.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 65.340000000000003 111.128 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -51.34 -49.11 62.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.173 -0.467 . . . . 61.420000000000002 110.917 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -56.98 -46.47 82.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 52.450000000000003 110.919 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -59.14 -37.79 78.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.228 -0.442 . . . . 74.209999999999994 110.91 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.09 -43.53 82.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.231 -0.44 . . . . 75.409999999999997 110.892 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -65.5 -36.07 82.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.263 -0.426 . . . . 73.530000000000001 110.858 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -72.96 -38.0 66.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 70.310000000000002 110.913 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 5.9 p . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 64.319999999999993 111.168 -179.929 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' -7' ' ' PHE . . . . . 0.4 ' HD2' HD23 ' A' ' 49' ' ' LEU . 31.8 m-85 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.783 0.325 . . . . 71.409999999999997 110.845 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 31.2 mm 51.18 81.42 0.26 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.649 0.738 . . . . 62.219999999999999 111.146 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 81.7 0.81 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.676 2.251 . . . . 61.539999999999999 112.323 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 40.6 t -89.06 3.0 53.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.24 -0.436 . . . . 74.010000000000005 110.84 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -50.97 162.83 0.55 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.606 0.717 . . . . 64.450000000000003 110.836 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 -23.05 31.36 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.684 2.256 . . . . 51.030000000000001 112.344 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.01 90.49 0.09 OUTLIER Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.583 0.706 . . . . 71.019999999999996 111.07 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 158.41 57.0 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.71 2.273 . . . . 63.32 112.311 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.97 150.38 40.47 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.566 0.698 . . . . 72.549999999999997 110.926 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 166.21 28.36 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.622 2.214 . . . . 73.120000000000005 112.358 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--O 1.231 0.168 0 C-N-CA 122.656 2.237 . . . . 75.5 112.342 179.976 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.447 HD11 ' HB ' ' A' ' 28' ' ' ILE . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.835 0.35 . . . . 74.109999999999999 110.932 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.599 ' HB2' HD23 ' A' ' 60' ' ' LEU . 68.0 m-85 -139.49 163.42 32.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 75.099999999999994 110.887 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.504 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -134.44 167.15 21.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.149 -0.478 . . . . 53.210000000000001 111.098 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.3 p -128.51 128.86 68.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 74.319999999999993 111.157 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.693 HG21 HG11 ' A' ' 20' ' ' VAL . 0.7 OUTLIER -72.16 138.42 47.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 63.43 111.132 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.632 HD11 ' HB2' ' A' ' 56' ' ' ARG . 18.0 mt -114.47 -15.39 12.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.229 -0.441 . . . . 62.350000000000001 110.956 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -137.42 158.35 44.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.139 -0.482 . . . . 73.099999999999994 110.927 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -83.04 104.83 13.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.1 -0.5 . . . . 64.349999999999994 110.874 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -88.96 103.81 16.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.192 -0.458 . . . . 73.129999999999995 110.892 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.1 mttm -79.4 112.05 16.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 62.340000000000003 110.918 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.616 ' HB1' ' HB2' ' A' ' 17' ' ' GLU . . . -71.85 163.11 28.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.237 -0.438 . . . . 63.049999999999997 111.122 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -119.01 -31.46 4.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.456 . . . . 73.439999999999998 110.909 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.1 mmm-85 -139.38 -174.76 3.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 55.149999999999999 110.814 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -64.54 -39.93 94.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 45.420000000000002 110.823 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.41 -28.0 40.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.194 -0.457 . . . . 73.319999999999993 110.87 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.616 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 40.0 mm-40 -88.98 -178.16 5.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 74.420000000000002 110.909 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.6 tp -150.41 123.18 8.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.122 -0.49 . . . . 60.240000000000002 110.912 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -80.53 124.52 29.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.214 -0.448 . . . . 72.349999999999994 110.913 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.693 HG11 HG21 ' A' ' 6' ' ' THR . 7.4 p -139.53 155.06 25.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.441 . . . . 62.299999999999997 111.123 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.0 m -111.11 159.34 33.08 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.65 0.738 . . . . 75.219999999999999 110.829 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 123.01 9.67 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.642 2.228 . . . . 72.409999999999997 112.32 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.41 -3.32 32.81 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.775 -0.726 . . . . 61.049999999999997 112.488 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -89.98 145.7 24.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.891 0.377 . . . . 75.310000000000002 110.874 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -86.67 142.06 28.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 75.310000000000002 110.842 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.54 HD11 HG21 ' A' ' 20' ' ' VAL . 5.3 mp -144.46 151.91 39.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.466 . . . . 71.409999999999997 110.922 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.5 t -107.08 125.56 51.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 64.129999999999995 110.876 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.504 HD11 ' HB2' ' A' ' 4' ' ' ALA . 53.5 mt -86.06 143.97 10.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 71.530000000000001 111.146 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 23.5 m -112.55 -37.72 4.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.18 -0.464 . . . . 74.049999999999997 110.922 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -164.27 176.16 9.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 74.510000000000005 111.129 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.428 ' CE1' HG21 ' A' ' 81' ' ' ILE . 1.6 p80 -126.61 178.26 6.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 74.409999999999997 110.876 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.73 ' OH ' HG23 ' B' ' -6' ' ' ILE . 40.5 t80 -141.03 99.65 3.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.211 -0.45 . . . . 72.25 110.903 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 54.92 24.01 5.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.129 -0.487 . . . . 62.009999999999998 110.858 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.593 ' HD2' HD12 ' A' ' 81' ' ' ILE . 35.7 m-85 63.6 15.3 8.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.201 -0.454 . . . . 75.030000000000001 110.92 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.431 ' O ' HG23 ' A' ' 52' ' ' VAL . 22.0 mm-40 -103.32 -49.17 3.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.498 . . . . 74.430000000000007 110.896 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -114.52 146.16 41.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 70.409999999999997 110.918 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.726 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -119.18 149.11 42.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.435 . . . . 75.340000000000003 110.897 -179.965 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.2 mm -108.53 96.27 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 74.25 111.103 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.464 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -105.71 161.62 14.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 73.200000000000003 111.133 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -136.59 158.32 73.45 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.534 0.683 . . . . 71.140000000000001 110.879 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.79 131.87 22.1 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.689 2.26 . . . . 64.310000000000002 112.372 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 27.0 mm . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.446 . . . . 75.129999999999995 111.104 179.945 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.231 0.139 0 CA-C-O 120.813 0.255 . . . . 63.399999999999999 112.337 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -126.19 -105.34 1.44 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.719 -0.753 . . . . 62.210000000000001 112.447 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -162.63 125.69 2.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.85 0.357 . . . . 63.25 110.896 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.413 HG23 ' HD2' ' A' ' 51' ' ' PRO . 10.0 p -136.51 132.99 18.95 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.583 0.706 . . . . 74.420000000000002 111.107 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.51 ' O ' HG22 ' A' ' 55' ' ' VAL . 54.0 Cg_endo -69.74 144.87 55.53 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.686 2.257 . . . . 61.409999999999997 112.347 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.726 HG22 ' CD2' ' A' ' 37' ' ' PHE . 18.4 t -58.24 -22.15 19.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 72.239999999999995 111.16 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.1 m -77.61 -2.55 36.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.476 . . . . 71.519999999999996 110.814 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.443 ' O ' HG13 ' A' ' 55' ' ' VAL . 10.8 m-85 -125.82 22.93 7.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.485 . . . . 73.349999999999994 110.91 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.51 HG22 ' O ' ' A' ' 51' ' ' PRO . 1.7 m -156.27 154.75 6.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.121 -0.491 . . . . 60.130000000000003 111.121 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.632 ' HB2' HD11 ' A' ' 7' ' ' LEU . 37.6 ttm-85 -121.41 128.44 52.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 74.540000000000006 110.873 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.631 HD11 ' CE2' ' A' ' 37' ' ' PHE . 42.5 mm -76.72 110.02 11.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.183 -0.462 . . . . 52.32 111.136 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.404 HG23 ' HG2' ' A' ' 56' ' ' ARG . 7.0 pt -126.13 -177.78 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.479 . . . . 54.439999999999998 111.082 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -126.09 124.48 40.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.162 -0.472 . . . . 45.399999999999999 110.895 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.599 HD23 ' HB2' ' A' ' 3' ' ' PHE . 0.4 OUTLIER -55.02 -26.39 36.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 74.219999999999999 110.913 -179.94 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.6 mpp? -90.17 -25.57 20.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 64.5 110.917 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -147.83 75.0 11.11 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.601 0.715 . . . . 63.409999999999997 110.872 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.724 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.8 Cg_endo -69.79 -8.39 23.49 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.676 2.251 . . . . 73.430000000000007 112.331 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -100.14 -12.92 19.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 52.009999999999998 111.132 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.5 ttmm -80.02 -52.1 8.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 52.340000000000003 110.908 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.435 ' O ' HG12 ' A' ' 69' ' ' VAL . 78.9 m-85 -95.45 23.11 6.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.446 . . . . 75.430000000000007 110.931 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.724 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -90.06 9.91 26.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 74.230000000000004 111.101 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 64.4 p -116.62 -24.13 7.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.221 -0.445 . . . . 74.450000000000003 110.796 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.527 HG21 ' CD1' ' A' ' 80' ' ' ILE . 13.9 p -56.65 135.28 20.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.17 -0.468 . . . . 71.329999999999998 111.12 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -90.33 100.67 13.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 74.140000000000001 110.848 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.698 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -57.78 -30.47 65.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 71.150000000000006 111.115 -179.851 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -62.72 -44.64 95.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.228 -0.442 . . . . 73.319999999999993 110.916 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.6 t0 -63.72 106.56 1.0 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.491 . . . . 72.519999999999996 110.869 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.44 -27.94 27.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 72.430000000000007 110.851 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -66.52 -54.46 23.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 74.019999999999996 110.884 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.455 ' O ' HD12 ' A' ' 80' ' ' ILE . 28.2 mt-30 -59.75 -57.62 12.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.146 -0.479 . . . . 73.450000000000003 110.912 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 4.3 p -51.89 -32.76 15.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 72.510000000000005 111.12 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 16.5 mtm -67.87 -50.82 54.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 54.240000000000002 110.902 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.4 mttt -56.28 -43.86 79.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.254 -0.43 . . . . 52.409999999999997 110.854 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.591 HG21 HG21 ' A' ' 57' ' ' ILE . 1.6 mp -63.97 -54.82 26.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 74.109999999999999 111.131 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.651 HG23 ' HB ' ' A' ' 86' ' ' ILE . 87.2 mt -57.68 -37.02 56.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.222 -0.445 . . . . 72.530000000000001 111.129 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -71.07 -51.71 23.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.21 -0.45 . . . . 64.239999999999995 110.834 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -59.47 -50.26 74.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 74.5 110.898 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -67.88 -13.42 62.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 71.099999999999994 110.906 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 63.1 mmtt 61.11 48.36 6.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.097 -0.501 . . . . 73.430000000000007 110.906 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.651 ' HB ' HG23 ' A' ' 81' ' ' ILE . 24.6 mt -81.66 122.43 80.48 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.651 0.739 . . . . 71.109999999999999 111.118 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.8 159.49 53.2 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.703 2.269 . . . . 72.530000000000001 112.32 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.407 HG22 ' O ' ' A' ' 31' ' ' HIS . 0.1 OUTLIER -81.38 174.81 11.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.216 -0.447 . . . . 73.420000000000002 111.1 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.817 HG12 ' HE2' ' A' ' 93' ' ' LYS . 24.1 t -53.81 -58.53 3.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.459 . . . . 62.219999999999999 111.136 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -50.75 -47.68 59.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 72.329999999999998 110.874 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -56.12 -39.24 71.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.458 . . . . 73.549999999999997 110.912 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -62.03 -48.43 80.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 73.439999999999998 110.89 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.817 ' HE2' HG12 ' A' ' 89' ' ' VAL . 17.7 mtmt -58.09 -50.79 72.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.217 -0.447 . . . . 73.230000000000004 110.897 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -58.35 -51.68 68.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.258 -0.428 . . . . 53.140000000000001 110.865 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -50.63 -52.56 38.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 75.400000000000006 110.897 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 74.329999999999998 111.118 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.87 0.367 . . . . 72.049999999999997 110.866 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' -6' ' ' ILE . . . . . 0.73 HG23 ' OH ' ' A' ' 32' ' ' TYR . 3.5 mp 47.95 84.73 0.19 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.618 0.723 . . . . 74.409999999999997 111.103 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 85.53 0.61 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.688 2.259 . . . . 72.439999999999998 112.361 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 1.3 t -74.28 -8.47 56.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.216 -0.447 . . . . 61.310000000000002 110.888 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.08 160.39 6.37 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.609 0.719 . . . . 71.209999999999994 110.872 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 154.65 67.72 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.688 2.258 . . . . 74.329999999999998 112.333 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -107.92 87.42 3.73 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.565 0.698 . . . . 70.129999999999995 111.108 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 149.0 66.57 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.721 2.281 . . . . 74.319999999999993 112.374 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.0 159.91 64.5 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.58 0.705 . . . . 74.439999999999998 110.86 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 167.11 25.46 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.626 2.217 . . . . 54.409999999999997 112.351 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--O 1.231 0.151 0 C-N-CA 122.69 2.26 . . . . 64.239999999999995 112.335 179.993 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.825 0.345 . . . . 62.43 110.96 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.474 ' CE1' HD12 ' A' ' 60' ' ' LEU . 14.0 m-85 -128.23 163.14 25.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.209 -0.45 . . . . 71.25 110.913 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.428 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -134.6 170.05 16.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 73.519999999999996 111.122 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 24' ' ' GLU . 8.4 p -133.14 131.27 58.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 74.319999999999993 111.092 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.723 HG21 ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -75.05 134.53 41.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 71.040000000000006 111.171 179.98 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.66 HD11 ' HB2' ' A' ' 56' ' ' ARG . 15.6 mt -109.22 -13.05 14.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 62.130000000000003 110.919 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -137.31 156.23 48.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 70.140000000000001 110.896 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -83.55 104.98 14.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.11 -0.495 . . . . 54.200000000000003 110.886 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -108.72 102.43 11.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.178 -0.465 . . . . 74.209999999999994 110.848 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp -78.96 124.34 28.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.114 -0.494 . . . . 73.450000000000003 110.928 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.588 ' HB1' ' HB2' ' A' ' 17' ' ' GLU . . . -65.41 145.4 56.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 72.239999999999995 111.105 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -96.65 -31.62 12.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 55.399999999999999 110.899 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -140.21 179.17 6.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.136 -0.484 . . . . 75.239999999999995 110.907 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -59.87 -29.78 68.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.216 -0.447 . . . . 75.040000000000006 110.906 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -65.15 -24.56 67.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 64.5 110.868 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.588 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 44.4 mm-40 -104.79 147.92 27.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.459 . . . . 71.430000000000007 110.896 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 tp -118.12 119.18 33.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.165 -0.47 . . . . 74.409999999999997 110.965 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -57.31 141.34 47.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 63.539999999999999 110.865 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.723 ' HB ' HG21 ' A' ' 6' ' ' THR . 0.8 OUTLIER -145.4 158.69 13.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 73.239999999999995 111.124 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.5 m -129.09 160.32 64.33 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.656 0.741 . . . . 73.109999999999999 110.877 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 119.46 6.41 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.687 2.258 . . . . 72.239999999999995 112.374 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.49 -0.46 30.86 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.741 -0.742 . . . . 51.409999999999997 112.468 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.559 ' O ' HG23 ' A' ' 5' ' ' VAL . 4.7 mp0 -88.24 166.0 14.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.82 0.343 . . . . 70.209999999999994 110.888 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.468 ' CB ' HD12 ' A' ' 42' ' ' ILE . 4.4 m120 -117.38 127.03 53.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 64.430000000000007 110.917 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.589 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 2.2 mp -127.41 158.99 35.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 74.340000000000003 110.917 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.0 t -111.13 114.87 28.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 74.200000000000003 110.878 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.428 HD11 ' HB2' ' A' ' 4' ' ' ALA . 57.2 mt -79.69 144.61 10.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 75.129999999999995 111.143 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 29.3 m -118.36 -41.65 2.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 74.340000000000003 110.899 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.411 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -155.67 174.63 15.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 74.420000000000002 111.093 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.471 ' ND1' HD13 ' A' ' 81' ' ' ILE . 1.3 p80 -126.89 177.73 6.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 70.209999999999994 110.868 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.2 t80 -139.91 99.56 3.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 75.319999999999993 110.941 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 55.11 25.16 6.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 64.019999999999996 110.843 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.59 ' HD2' HD12 ' A' ' 81' ' ' ILE . 34.2 m-85 63.48 16.3 9.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.225 -0.443 . . . . 74.109999999999999 110.935 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.465 ' O ' HG23 ' A' ' 52' ' ' VAL . 12.2 mm-40 -103.62 -50.32 3.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 73.510000000000005 110.935 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.427 ' CZ2' ' HB2' ' B' ' -3' ' ' ARG . 78.5 m95 -113.06 153.78 27.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.09 -0.505 . . . . 75.540000000000006 110.923 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.634 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.4 OUTLIER -126.38 142.64 51.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.25 -0.432 . . . . 71.319999999999993 110.933 -179.998 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 21.7 mm -99.16 95.64 4.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.154 -0.475 . . . . 74.239999999999995 111.109 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.589 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -108.1 152.86 23.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.461 . . . . 73.140000000000001 111.13 179.754 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.2 mtpt -125.1 159.49 59.03 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.589 0.709 . . . . 74.420000000000002 110.905 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.7 139.74 41.17 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.67 2.247 . . . . 74.549999999999997 112.381 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.468 HD12 ' CB ' ' A' ' 25' ' ' ASN . 44.2 mt . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.447 . . . . 75.310000000000002 111.177 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.827 0.261 . . . . 64.540000000000006 112.357 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -116.91 -111.8 2.65 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.751 -0.738 . . . . 71.349999999999994 112.518 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -172.12 124.61 0.52 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.843 0.354 . . . . 65.239999999999995 110.949 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.42 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.1 p -139.46 132.98 15.65 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.58 0.705 . . . . 64.230000000000004 111.146 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.579 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.1 Cg_endo -69.75 160.58 49.19 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.66 2.24 . . . . 73.230000000000004 112.325 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.764 HG12 ' HB ' ' A' ' 71' ' ' THR . 8.4 t -72.11 -20.97 20.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 64.019999999999996 111.114 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.0 m -79.15 -0.17 30.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 72.439999999999998 110.832 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -127.49 17.36 7.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 71.409999999999997 110.947 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.579 HG22 ' O ' ' A' ' 51' ' ' PRO . 16.8 m -151.87 161.15 3.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.086 -0.507 . . . . 53.43 111.115 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.66 ' HB2' HD11 ' A' ' 7' ' ' LEU . 39.0 ttm-85 -128.99 131.75 47.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.166 -0.47 . . . . 61.32 110.845 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.404 HG21 HG21 ' A' ' 80' ' ' ILE . 31.1 mm -80.59 108.85 14.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 75.430000000000007 111.124 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.445 HG23 ' HG2' ' A' ' 56' ' ' ARG . 4.6 pt -126.81 140.19 49.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 64.540000000000006 111.078 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -76.36 128.57 35.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.136 -0.483 . . . . 71.049999999999997 110.872 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.474 HD12 ' CE1' ' A' ' 3' ' ' PHE . 0.6 OUTLIER -60.42 -34.97 74.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.181 -0.463 . . . . 73.340000000000003 110.872 -179.943 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.1 mmt -83.78 -1.6 54.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 73.040000000000006 110.894 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -178.91 82.93 0.21 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.665 0.745 . . . . 62.020000000000003 110.884 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.724 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.3 Cg_endo -69.81 -7.93 22.31 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.704 2.27 . . . . 71.310000000000002 112.284 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.46 -8.49 44.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 73.120000000000005 111.146 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -81.97 -47.09 13.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 62.210000000000001 110.883 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.641 ' O ' HG12 ' A' ' 69' ' ' VAL . 14.2 m-85 -103.72 23.47 12.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 73.310000000000002 110.916 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.724 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -84.23 -16.87 41.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 54.009999999999998 111.09 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 39.8 p -94.18 -23.76 17.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 71.340000000000003 110.829 -179.734 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.988 HG21 HD11 ' A' ' 80' ' ' ILE . 9.8 p -51.33 155.95 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.083 -0.508 . . . . 73.230000000000004 111.168 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -113.31 106.77 15.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 75.420000000000002 110.857 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.764 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.1 OUTLIER -70.5 -20.81 62.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.445 . . . . 75.030000000000001 111.14 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -62.77 -54.91 31.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.231 -0.441 . . . . 74.109999999999999 110.91 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -63.89 116.73 6.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 73.540000000000006 110.893 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.48 -22.14 41.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 75.150000000000006 110.896 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -66.84 -56.01 12.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.175 -0.466 . . . . 74.340000000000003 110.928 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -58.71 -57.12 14.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 62.240000000000002 110.924 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.513 ' HA ' HD12 ' A' ' 80' ' ' ILE . 3.2 p -52.72 -31.91 16.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 73.200000000000003 111.13 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.8 mtm -67.57 -55.12 14.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 61.229999999999997 110.865 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 50.8 mttt -55.36 -38.64 69.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 75.239999999999995 110.944 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.988 HD11 HG21 ' A' ' 69' ' ' VAL . 15.4 mt -65.3 -53.08 44.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.226 -0.443 . . . . 73.530000000000001 111.105 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.721 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.1 mt -61.95 -35.9 70.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 73.019999999999996 111.145 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -71.02 -44.77 65.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 72.409999999999997 110.905 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -67.89 -47.84 67.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 71.200000000000003 110.891 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -69.21 -11.5 60.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 74.5 110.86 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 45.9 mmtt 58.32 53.89 6.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.461 . . . . 72.450000000000003 110.887 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.721 ' HB ' HG23 ' A' ' 81' ' ' ILE . 23.7 mt -88.14 124.33 66.88 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 75.239999999999995 111.134 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.411 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 53.3 Cg_endo -69.76 164.15 35.63 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.642 2.228 . . . . 54.439999999999998 112.33 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.97 167.33 13.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 65.409999999999997 111.128 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.473 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 97.7 t -50.61 -58.41 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 74.129999999999995 111.122 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -46.05 -53.16 10.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 72.129999999999995 110.906 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 74.9 mm-40 -56.38 -34.16 66.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 63.009999999999998 110.913 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' TRP . . . . . 0.453 ' O ' HG23 ' A' ' 96' ' ' THR . 26.8 t90 -71.25 -36.2 71.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.199 -0.455 . . . . 74.530000000000001 110.878 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' A' ' 89' ' ' VAL . 1.6 mmmt -68.62 -37.56 79.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.451 . . . . 71.230000000000004 110.917 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -71.38 -50.83 28.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.227 -0.442 . . . . 74.230000000000004 110.888 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLN . . . . . 0.412 ' HG2' ' HA ' ' A' ' 92' ' ' TRP . 5.1 pt20 -58.8 -38.83 79.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.194 -0.457 . . . . 73.129999999999995 110.867 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 96' ' ' THR . . . . . 0.453 HG23 ' O ' ' A' ' 92' ' ' TRP . 26.2 p . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.251 -0.431 . . . . 62.340000000000003 111.093 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.848 0.356 . . . . 73.450000000000003 110.91 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.8 mm 51.41 74.37 0.81 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.651 0.739 . . . . 42.030000000000001 111.119 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 101.26 0.9 Allowed 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.703 2.268 . . . . 75.040000000000006 112.326 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 24.2 t -89.33 1.47 55.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 71.099999999999994 110.841 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' -3' ' ' ARG . . . . . 0.427 ' HB2' ' CZ2' ' A' ' 36' ' ' TRP . 19.7 mmt-85 -50.75 160.38 0.79 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.589 0.709 . . . . 74.340000000000003 110.915 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 -22.88 31.62 Favored 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.725 2.283 . . . . 45.420000000000002 112.354 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.6 85.03 0.17 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.585 0.707 . . . . 74.329999999999998 111.122 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 159.45 53.41 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.742 2.295 . . . . 73.140000000000001 112.303 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 11.4 mtpt -94.7 160.08 32.12 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.565 0.698 . . . . 74.129999999999995 110.9 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 166.66 26.76 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.668 2.245 . . . . 63.329999999999998 112.369 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo . . . . . 0 C--O 1.231 0.145 0 C-N-CA 122.7 2.267 . . . . 71.409999999999997 112.332 179.936 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 pt? . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.814 0.34 . . . . 74.319999999999993 110.932 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -112.06 145.15 40.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.258 -0.428 . . . . 65.319999999999993 110.893 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.608 ' HB1' HG13 ' A' ' 55' ' ' VAL . . . -126.66 153.57 45.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 73.310000000000002 111.118 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 24' ' ' GLU . 6.6 p -121.66 122.5 67.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.24 -0.436 . . . . 60.109999999999999 111.129 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -59.18 140.17 56.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 64.310000000000002 111.126 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.586 HD21 ' HB2' ' A' ' 56' ' ' ARG . 3.5 mt -106.04 -16.42 14.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 70.439999999999998 110.907 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -139.25 164.31 30.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 61.240000000000002 110.911 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -87.19 104.8 16.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 72.010000000000005 110.895 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -106.74 109.37 21.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 73.230000000000004 110.86 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -83.84 142.24 30.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.105 -0.498 . . . . 75.439999999999998 110.947 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.62 136.1 50.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.425 . . . . 60.210000000000001 111.093 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -105.53 -26.61 11.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.449 . . . . 72.409999999999997 110.884 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -127.1 -178.59 4.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.49 . . . . 63.43 110.886 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -67.43 -25.97 66.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 64.129999999999995 110.879 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.74 -45.6 15.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 73.010000000000005 110.823 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -55.88 158.27 3.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 70.519999999999996 110.939 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tp -133.73 145.81 50.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 65.239999999999995 110.918 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -82.65 130.74 35.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 74.129999999999995 110.881 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.989 HG11 HD21 ' A' ' 26' ' ' LEU . 0.2 OUTLIER -139.96 158.93 26.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 75.340000000000003 111.149 179.984 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -125.18 159.09 61.15 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.692 0.758 . . . . 55.299999999999997 110.873 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 117.78 5.29 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.698 2.265 . . . . 72.530000000000001 112.312 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.25 7.12 35.61 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.756 -0.735 . . . . 53.109999999999999 112.495 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.468 ' O ' HG23 ' A' ' 5' ' ' VAL . 24.4 mm-40 -92.2 153.69 19.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.898 0.38 . . . . 44.119999999999997 110.872 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.644 ' HB3' HD12 ' A' ' 42' ' ' ILE . 7.0 m120 -94.8 123.11 38.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.158 -0.474 . . . . 75.439999999999998 110.855 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.989 HD21 HG11 ' A' ' 20' ' ' VAL . 7.9 mp -124.1 149.32 46.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.208 -0.451 . . . . 71.319999999999993 110.907 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.79 123.89 46.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.457 . . . . 63.409999999999997 110.889 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 31.7 mm -74.74 144.84 11.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.132 -0.485 . . . . 72.409999999999997 111.087 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 55.8 m -124.6 -35.2 2.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.134 -0.485 . . . . 64.530000000000001 110.888 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -176.03 171.9 2.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 30.25 111.088 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.474 ' CE1' HG21 ' A' ' 81' ' ' ILE . 1.7 p80 -124.95 173.35 8.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 55.439999999999998 110.86 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -135.39 99.55 4.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.241 -0.436 . . . . 63.219999999999999 110.906 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.8 t0 53.88 26.46 6.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.116 -0.493 . . . . 54.439999999999998 110.878 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.53 ' HD2' HD12 ' A' ' 81' ' ' ILE . 43.7 m-85 62.77 27.77 16.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 64.099999999999994 110.938 -179.81 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -116.69 -48.24 2.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 65.319999999999993 110.9 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 70.1 m95 -114.09 145.86 41.04 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.153 -0.476 . . . . 73.239999999999995 110.942 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.575 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -121.08 139.46 53.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.258 -0.428 . . . . 72.510000000000005 110.9 -179.931 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.6 mm -95.02 95.21 4.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.191 -0.459 . . . . 72.040000000000006 111.124 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.811 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -107.55 145.06 33.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 73.420000000000002 111.102 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -123.53 156.59 64.09 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.567 0.698 . . . . 75.230000000000004 110.89 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 125.71 12.45 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.672 2.248 . . . . 63.210000000000001 112.367 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.644 HD12 ' HB3' ' A' ' 25' ' ' ASN . 58.4 mt . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 71.450000000000003 111.131 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo . . . . . 0 C--O 1.23 0.117 0 CA-C-O 120.798 0.249 . . . . 64.25 112.351 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -116.72 -122.19 3.33 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.787 -0.721 . . . . 65.010000000000005 112.5 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -160.18 125.3 3.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.846 0.355 . . . . 71.239999999999995 110.882 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.426 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.2 p -139.98 133.29 15.23 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.609 0.719 . . . . 51.140000000000001 111.134 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.426 ' HD2' HG23 ' A' ' 50' ' ' VAL . 54.4 Cg_endo -69.75 150.32 68.14 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.683 2.255 . . . . 75.230000000000004 112.378 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.726 HG12 ' HB ' ' A' ' 71' ' ' THR . 21.6 t -58.0 -22.06 18.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 72.420000000000002 111.142 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.9 m -77.97 -2.08 35.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 50.219999999999999 110.822 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -126.1 10.19 7.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 72.140000000000001 110.912 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.608 HG13 ' HB1' ' A' ' 4' ' ' ALA . 2.4 t -147.21 139.73 19.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.494 . . . . 71.319999999999993 111.107 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.586 ' HB2' HD21 ' A' ' 7' ' ' LEU . 31.9 ttm180 -104.97 131.21 52.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 71.140000000000001 110.904 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.496 HG21 HG21 ' A' ' 80' ' ' ILE . 30.0 mm -87.16 108.94 18.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 73.209999999999994 111.126 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.554 HG23 ' HG2' ' A' ' 56' ' ' ARG . 3.1 pt -123.01 160.47 25.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 74.120000000000005 111.101 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 60.8 t0 -97.38 125.38 41.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 74.129999999999995 110.844 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mt -51.65 -37.55 50.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.476 . . . . 52.340000000000003 110.928 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.79 -31.27 35.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.141 -0.481 . . . . 71.109999999999999 110.912 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ASP . . . . . 0.42 ' HB2' ' HB2' ' A' ' 65' ' ' LYS . 0.1 OUTLIER -137.69 78.32 37.22 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.606 0.717 . . . . 72.209999999999994 110.898 179.969 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.766 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.7 Cg_endo -69.8 -8.12 22.8 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.641 2.227 . . . . 61.149999999999999 112.354 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.84 -33.68 11.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 35.399999999999999 111.123 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' LYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 62' ' ' ASP . 0.0 OUTLIER -65.14 -51.8 59.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 50.119999999999997 110.87 179.989 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.525 ' HA ' HG23 ' A' ' 69' ' ' VAL . 20.3 m-85 -90.78 18.95 5.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.436 . . . . 75.040000000000006 110.933 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.766 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -84.14 -23.06 30.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.122 -0.49 . . . . 73.219999999999999 111.11 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 47.3 t -94.6 -5.68 45.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 71.099999999999994 110.844 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.525 HG23 ' HA ' ' A' ' 66' ' ' TYR . 53.6 t -51.26 121.78 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.117 -0.492 . . . . 75.209999999999994 111.147 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -77.53 75.72 4.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.189 -0.46 . . . . 62.299999999999997 110.864 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.726 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -47.43 -34.16 6.91 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.446 . . . . 62.219999999999999 111.136 -179.853 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -58.71 -44.47 90.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.218 -0.446 . . . . 72.430000000000007 110.898 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -69.09 113.98 6.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.104 -0.498 . . . . 73.129999999999995 110.866 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.22 -23.77 37.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 74.349999999999994 110.884 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -65.78 -54.98 19.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 74.030000000000001 110.872 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' GLN . . . . . 0.715 ' O ' HD12 ' A' ' 80' ' ' ILE . 0.0 OUTLIER -58.67 -58.23 9.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 73.319999999999993 110.875 -179.942 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -51.61 -31.68 12.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.274 -0.421 . . . . 73.450000000000003 111.171 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 9.2 mtm -68.71 -51.11 45.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.104 -0.498 . . . . 61.119999999999997 110.846 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -56.95 -43.36 81.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.447 . . . . 74.420000000000002 110.86 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.715 HD12 ' O ' ' A' ' 76' ' ' GLN . 1.8 mp -64.43 -53.35 43.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 73.209999999999994 111.15 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.53 HD12 ' HD2' ' A' ' 34' ' ' TYR . 88.5 mt -59.64 -36.65 66.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 72.439999999999998 111.113 179.819 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -71.17 -52.25 20.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 63.43 110.891 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -60.77 -50.84 71.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 65.109999999999999 110.894 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -67.82 -15.07 63.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 75.209999999999994 110.9 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp 57.88 51.82 8.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 71.5 110.923 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.449 HD12 HG12 ' A' ' 81' ' ' ILE . 27.8 mt -77.94 131.5 69.91 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.658 0.742 . . . . 71.349999999999994 111.123 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 152.0 69.29 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.661 2.24 . . . . 73.430000000000007 112.352 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.73 170.24 15.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 75.0 111.188 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 31' ' ' HIS . 95.2 t -52.01 -55.2 10.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.253 -0.43 . . . . 70.310000000000002 111.166 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -51.95 -46.42 64.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.142 -0.481 . . . . 70.340000000000003 110.868 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 58.7 mm-40 -59.68 -42.7 93.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 73.329999999999998 110.936 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 25.3 t90 -64.94 -38.26 90.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 74.439999999999998 110.925 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.86 -49.54 70.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 74.430000000000007 110.923 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -61.65 -45.44 94.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.45 . . . . 73.230000000000004 110.843 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -58.78 -51.67 68.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 74.120000000000005 110.881 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 5.5 p . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 116.156 -0.474 . . . . 73.340000000000003 111.182 -179.931 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.8 0.333 . . . . 74.549999999999997 110.902 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 22.3 mm 50.51 80.3 0.3 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.661 0.743 . . . . 73.310000000000002 111.138 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 113.49 3.39 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.668 2.245 . . . . 62.329999999999998 112.351 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -123.92 56.6 1.23 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 42.32 110.82 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' -3' ' ' ARG . . . . . 0.4 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 0.1 OUTLIER -109.94 163.59 16.77 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.591 0.71 . . . . 72.200000000000003 110.873 -179.928 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' -2' ' ' PRO . . . . . 0.4 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.4 Cg_endo -69.84 -6.46 18.69 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.655 2.237 . . . . 54.329999999999998 112.359 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 51.47 88.13 0.12 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.554 0.692 . . . . 74.519999999999996 111.105 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.76 126.6 13.5 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.678 2.252 . . . . 42.25 112.371 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 19.2 mtmm -66.34 160.1 67.94 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.532 0.682 . . . . 75.319999999999993 110.931 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 167.32 24.76 Favored 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.719 2.279 . . . . 75.530000000000001 112.372 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 N--CA 1.466 -0.141 0 C-N-CA 122.719 2.279 . . . . 70.340000000000003 112.322 179.963 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.9 pp . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.819 0.342 . . . . 72.099999999999994 110.942 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -117.45 163.61 16.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 73.310000000000002 110.881 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.429 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -134.93 164.13 28.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 64.549999999999997 111.118 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 24' ' ' GLU . 7.6 p -131.6 131.09 62.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 74.019999999999996 111.148 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.713 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -72.87 136.56 45.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.194 -0.457 . . . . 73.140000000000001 111.137 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.669 HD11 ' HB2' ' A' ' 56' ' ' ARG . 17.4 mt -108.37 -16.07 14.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 73.439999999999998 110.917 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -135.35 161.85 34.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.451 . . . . 53.310000000000002 110.909 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -84.35 105.02 14.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.085 -0.507 . . . . 73.310000000000002 110.895 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -89.61 100.24 13.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 54.539999999999999 110.912 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -80.23 106.85 12.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 74.129999999999995 110.868 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.526 ' HB1' ' HB2' ' A' ' 17' ' ' GLU . . . -58.23 152.83 16.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 73.510000000000005 111.098 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -113.73 -30.97 6.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.242 -0.435 . . . . 73.340000000000003 110.92 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.5 mmp_? -121.21 -179.85 4.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.136 -0.484 . . . . 63.130000000000003 110.906 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -64.12 -39.1 93.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.456 . . . . 62.0 110.844 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -63.11 -50.82 69.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.443 . . . . 71.329999999999998 110.865 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.526 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 55.5 mm-40 -55.07 135.65 48.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 72.349999999999994 110.894 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.7 tp -108.37 136.93 47.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 64.120000000000005 110.907 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -85.18 128.68 34.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 64.230000000000004 110.859 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.713 ' CG1' HG21 ' A' ' 6' ' ' THR . 7.1 p -140.19 143.3 29.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 64.439999999999998 111.127 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -101.81 160.36 26.7 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.688 0.756 . . . . 33.409999999999997 110.836 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 121.79 8.48 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.711 2.274 . . . . 75.349999999999994 112.319 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.12 5.69 30.36 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.701 -0.761 . . . . 72.140000000000001 112.479 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLU . . . . . 0.623 ' O ' HG23 ' A' ' 5' ' ' VAL . 29.5 mt-10 -92.2 169.2 10.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.883 0.373 . . . . 72.409999999999997 110.884 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -113.51 123.33 49.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 74.140000000000001 110.836 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.694 HD11 HG21 ' A' ' 20' ' ' VAL . 4.4 mp -123.18 150.12 43.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.109 -0.496 . . . . 71.230000000000004 110.929 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.94 112.92 26.17 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.175 -0.466 . . . . 63.43 110.832 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.429 HD11 ' HB2' ' A' ' 4' ' ' ALA . 59.6 mt -76.77 145.36 10.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 74.200000000000003 111.17 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.7 m -119.51 -32.6 4.29 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.137 -0.483 . . . . 75.409999999999997 110.874 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.418 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -170.04 174.09 5.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 42.219999999999999 111.08 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.416 ' CG ' HD13 ' A' ' 81' ' ' ILE . 2.7 p80 -123.77 178.02 5.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 64.329999999999998 110.844 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -150.66 104.67 3.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 65.420000000000002 110.912 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 59.93 17.75 6.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.111 -0.495 . . . . 72.340000000000003 110.859 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.61 ' HD2' HD12 ' A' ' 81' ' ' ILE . 24.1 m-85 60.97 20.82 11.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 73.219999999999999 110.902 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -117.68 -24.42 7.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 71.430000000000007 110.912 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.408 ' HB3' HD21 ' A' ' 49' ' ' LEU . 81.3 m95 -132.23 135.81 46.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.107 -0.497 . . . . 75.129999999999995 110.902 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.615 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -118.08 131.99 56.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.202 -0.453 . . . . 74.209999999999994 110.877 -179.937 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.4 mm -89.13 94.74 4.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 53.409999999999997 111.142 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.408 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -115.54 152.34 33.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.457 . . . . 60.049999999999997 111.085 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.0 ptpp? -122.44 157.05 60.05 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.563 0.696 . . . . 72.319999999999993 110.908 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 136.7 33.76 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.683 2.255 . . . . 75.099999999999994 112.372 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 69.1 mt . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 64.5 111.155 179.923 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.466 -0.13 0 CA-C-O 120.837 0.266 . . . . 73.439999999999998 112.321 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -129.63 -138.29 4.39 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.753 -0.737 . . . . 52.439999999999998 112.472 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.417 HD12 ' HB3' ' B' ' -7' ' ' PHE . 0.7 OUTLIER -148.46 126.88 12.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.86 0.362 . . . . 72.140000000000001 110.885 -179.901 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.419 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.5 p -136.8 133.45 18.85 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.597 0.713 . . . . 73.140000000000001 111.126 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.419 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.6 Cg_endo -69.77 158.4 57.06 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.665 2.244 . . . . 73.400000000000006 112.349 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.781 HG12 ' HB ' ' A' ' 71' ' ' THR . 6.9 t -70.09 -20.57 23.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 70.310000000000002 111.138 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.9 m -81.24 3.82 22.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 62.219999999999999 110.853 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' TYR . . . . . 0.499 ' O ' HG22 ' A' ' 6' ' ' THR . 17.0 m-85 -131.94 22.1 4.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.474 . . . . 65.319999999999993 110.918 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.412 HG22 ' O ' ' A' ' 51' ' ' PRO . 18.8 m -152.14 160.34 3.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 74.219999999999999 111.163 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.669 ' HB2' HD11 ' A' ' 7' ' ' LEU . 21.4 ttp180 -127.62 120.56 28.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.228 -0.442 . . . . 73.049999999999997 110.89 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.6 mm -71.9 123.03 25.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 62.340000000000003 111.083 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.433 HG23 ' HG2' ' A' ' 56' ' ' ARG . 16.0 pt -141.86 172.07 10.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 71.420000000000002 111.143 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 48.8 t0 -119.42 129.74 54.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.466 . . . . 74.420000000000002 110.883 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 60' ' ' LEU . 16.6 mt -53.57 -27.73 27.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 72.030000000000001 110.908 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.2 mmt -88.01 -31.69 19.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 74.230000000000004 110.864 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -139.44 73.7 35.73 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.596 0.712 . . . . 73.120000000000005 110.863 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.531 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.8 Cg_endo -69.73 -8.58 23.97 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.731 2.288 . . . . 51.119999999999997 112.331 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -103.33 -12.8 17.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 72.319999999999993 111.091 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -75.23 -51.77 12.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.45 . . . . 71.120000000000005 110.906 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.623 ' O ' HG12 ' A' ' 69' ' ' VAL . 61.6 m-85 -96.77 23.13 7.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 73.430000000000007 110.943 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -85.83 -18.64 32.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 74.319999999999993 111.135 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 35.6 t -94.21 -23.42 17.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 62.399999999999999 110.904 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.994 HG21 HD11 ' A' ' 80' ' ' ILE . 7.4 p -51.29 154.83 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.119 -0.492 . . . . 74.219999999999999 111.118 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -107.89 110.24 21.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 61.32 110.853 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.781 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -71.65 -38.88 70.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 75.5 111.145 -179.913 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -55.11 -42.16 72.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.197 -0.456 . . . . 75.030000000000001 110.925 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 52.9 t0 -63.9 105.66 0.88 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 74.140000000000001 110.924 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.01 -29.24 20.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 72.430000000000007 110.845 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -66.98 -56.17 11.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 62.420000000000002 110.862 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -59.1 -55.07 39.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 71.040000000000006 110.905 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.463 ' HA ' HD12 ' A' ' 80' ' ' ILE . 5.4 p -54.24 -32.7 24.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 64.25 111.138 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.3 mtm -67.3 -55.68 12.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 45.450000000000003 110.9 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.8 mttm -55.02 -38.25 67.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.438 . . . . 65.120000000000005 110.883 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.994 HD11 HG21 ' A' ' 69' ' ' VAL . 34.4 mt -65.46 -54.88 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 72.129999999999995 111.132 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.73 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.8 mt -61.0 -36.1 69.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.139 -0.482 . . . . 64.040000000000006 111.149 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -71.03 -47.68 57.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 73.340000000000003 110.861 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -63.03 -52.36 63.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.162 -0.472 . . . . 64.129999999999995 110.88 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -67.87 -15.8 63.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 71.409999999999997 110.866 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.6 mmtm 60.95 62.07 1.51 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.484 . . . . 74.420000000000002 110.944 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.73 ' HB ' HG23 ' A' ' 81' ' ' ILE . 54.7 mt -92.05 132.42 32.6 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.615 0.722 . . . . 52.140000000000001 111.144 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.418 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 53.6 Cg_endo -69.81 169.93 17.84 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.707 2.272 . . . . 73.420000000000002 112.314 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -106.07 177.73 4.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 64.430000000000007 111.115 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.5 t -59.82 -52.79 56.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.204 -0.453 . . . . 71.019999999999996 111.118 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -54.15 -52.65 60.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 60.439999999999998 110.874 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -60.64 -38.78 85.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.156 -0.475 . . . . 73.319999999999993 110.937 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 31.2 t90 -66.45 -37.91 86.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.21 -0.45 . . . . 71.530000000000001 110.879 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.3 mmpt? -66.95 -49.38 65.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.273 -0.422 . . . . 73.140000000000001 110.899 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -61.74 -43.57 98.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 74.5 110.882 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -61.0 -52.91 63.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 73.430000000000007 110.89 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.9 p . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 75.310000000000002 111.166 -179.937 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' -7' ' ' PHE . . . . . 0.417 ' HB3' HD12 ' A' ' 49' ' ' LEU . 38.2 m-85 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.866 0.365 . . . . 75.340000000000003 110.895 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.6 mm 54.65 77.88 0.42 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.588 0.709 . . . . 71.310000000000002 111.155 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 87.49 0.56 Allowed 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.688 2.258 . . . . 72.329999999999998 112.294 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 33.5 t -104.01 34.17 3.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 55.43 110.859 -179.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' -3' ' ' ARG . . . . . 0.43 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 2.5 mtp85 -95.83 161.07 28.7 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.64 0.733 . . . . 74.030000000000001 110.852 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' -2' ' ' PRO . . . . . 0.43 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.4 Cg_endo -69.73 111.03 2.69 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.671 2.247 . . . . 74.409999999999997 112.342 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' -1' ' ' ALA . . . . . 0.411 ' HA ' ' HD2' ' B' ' 0' ' ' PRO . . . -50.09 108.2 0.96 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.595 0.712 . . . . 73.109999999999999 111.104 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 0' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' B' ' -1' ' ' ALA . 53.6 Cg_endo -69.81 145.69 57.6 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.73 2.287 . . . . 53.219999999999999 112.311 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -97.3 137.49 21.17 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.536 0.684 . . . . 74.109999999999999 110.903 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 165.67 30.21 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.647 2.231 . . . . 72.25 112.379 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 C--N 1.341 0.164 0 C-N-CA 122.688 2.259 . . . . 74.230000000000004 112.327 -179.998 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.79 HD11 HG13 ' A' ' 28' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.827 0.346 . . . . 64.530000000000001 110.938 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.78 ' CD2' HD22 ' A' ' 60' ' ' LEU . 16.6 m-30 -117.37 139.43 50.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 72.430000000000007 110.858 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -109.7 170.11 8.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 72.140000000000001 111.093 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.95 125.89 58.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 74.310000000000002 111.133 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.745 HG21 ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -71.84 135.45 46.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 65.329999999999998 111.14 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.466 HD11 ' HB2' ' A' ' 56' ' ' ARG . 40.3 mt -105.56 -16.34 14.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.246 -0.434 . . . . 61.439999999999998 110.89 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -138.39 158.3 44.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 74.200000000000003 110.912 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -84.27 104.74 14.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.07 -0.514 . . . . 52.140000000000001 110.875 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -97.17 123.36 40.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 74.099999999999994 110.846 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.73 121.13 40.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 73.099999999999994 110.892 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.58 ' HB1' ' HB3' ' A' ' 17' ' ' GLU . . . -63.46 164.9 8.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.223 -0.444 . . . . 71.239999999999995 111.09 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -116.44 -29.49 6.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.21 -0.45 . . . . 62.130000000000003 110.899 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 -135.89 -176.18 4.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 45.030000000000001 110.828 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -63.5 -43.23 97.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 70.310000000000002 110.858 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.06 -53.15 59.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.466 . . . . 74.430000000000007 110.876 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.58 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 1.9 tp10 -67.42 149.41 50.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.156 -0.474 . . . . 61.119999999999997 110.901 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.1 tp -121.17 154.16 36.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.484 . . . . 70.409999999999997 110.909 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -94.34 148.16 22.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.186 -0.461 . . . . 72.219999999999999 110.862 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.745 ' HB ' HG21 ' A' ' 6' ' ' THR . 0.1 OUTLIER -144.4 159.22 15.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 64.299999999999997 111.133 179.977 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -124.51 157.0 66.79 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.675 0.75 . . . . 71.310000000000002 110.861 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 117.68 5.23 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.726 2.284 . . . . 64.219999999999999 112.309 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.93 5.2 33.42 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.68 -0.771 . . . . 71.230000000000004 112.481 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -91.84 151.67 20.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.819 0.342 . . . . 64.340000000000003 110.905 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -100.69 113.36 26.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 72.519999999999996 110.878 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.702 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 4.1 mp -112.33 168.22 9.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.15 -0.477 . . . . 74.120000000000005 110.949 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.9 t -121.52 116.15 24.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.455 . . . . 43.039999999999999 110.843 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.79 HG13 HD11 ' A' ' 2' ' ' LEU . 27.9 mm -68.55 147.63 12.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 63.340000000000003 111.101 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 27.7 m -125.43 -37.05 2.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 74.140000000000001 110.875 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -170.25 171.76 6.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 52.409999999999997 111.123 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' HIS . . . . . 0.533 ' O ' HG22 ' A' ' 88' ' ' THR . 2.9 p80 -126.44 175.45 7.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.231 -0.44 . . . . 72.230000000000004 110.844 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -147.01 102.17 3.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 74.219999999999999 110.927 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 60.9 18.18 8.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.495 . . . . 64.209999999999994 110.85 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.581 ' CD2' HD12 ' A' ' 81' ' ' ILE . 43.9 m-85 62.1 19.82 11.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.177 -0.465 . . . . 63.530000000000001 110.931 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -119.03 -4.24 10.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.081 -0.509 . . . . 75.129999999999995 110.833 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.432 ' HB3' HD21 ' A' ' 49' ' ' LEU . 79.3 m95 -150.01 135.7 18.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.139 -0.482 . . . . 74.209999999999994 110.878 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.62 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -121.9 144.91 48.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 74.400000000000006 110.842 -179.944 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 11.7 mm -103.51 94.88 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.483 . . . . 75.430000000000007 111.141 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.702 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.19 139.49 45.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 64.140000000000001 111.123 179.777 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 pttp -115.33 157.11 44.73 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.547 0.689 . . . . 64.450000000000003 110.918 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 108.39 2.07 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.664 2.242 . . . . 72.409999999999997 112.328 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.416 HD11 ' CG ' ' A' ' 3' ' ' PHE . 62.3 mt . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 70.030000000000001 111.156 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo . . . . . 0 N--CA 1.466 -0.1 0 CA-C-O 120.864 0.277 . . . . 64.150000000000006 112.331 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -128.85 -136.93 4.24 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.756 -0.735 . . . . 75.239999999999995 112.485 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.507 HD12 ' HB3' ' B' ' -7' ' ' PHE . 1.0 OUTLIER -144.86 126.87 15.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.869 0.366 . . . . 65.120000000000005 110.876 -179.94 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.421 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.3 p -140.53 132.8 14.4 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.617 0.722 . . . . 54.109999999999999 111.107 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.421 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.8 Cg_endo -69.78 151.04 68.84 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.683 2.255 . . . . 75.200000000000003 112.37 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.74 HG12 ' HB ' ' A' ' 71' ' ' THR . 15.9 t -61.97 -21.67 26.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.243 -0.435 . . . . 73.439999999999998 111.133 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.9 t -77.56 -4.11 44.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 34.420000000000002 110.856 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -122.45 15.21 10.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.123 -0.489 . . . . 72.239999999999995 110.92 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.8 m -151.42 156.33 6.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 60.210000000000001 111.084 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.466 ' HB2' HD11 ' A' ' 7' ' ' LEU . 21.1 ttm180 -125.52 124.56 41.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 74.230000000000004 110.865 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ILE . . . . . 0.505 HG21 HG21 ' A' ' 80' ' ' ILE . 40.7 mm -74.72 108.98 6.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 73.010000000000005 111.143 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.461 HG23 ' HG2' ' A' ' 56' ' ' ARG . 1.1 pt -126.45 167.93 20.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 73.5 111.176 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -107.89 119.72 40.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.206 -0.452 . . . . 75.239999999999995 110.88 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.78 HD22 ' CD2' ' A' ' 3' ' ' PHE . 0.1 OUTLIER -50.78 -30.83 15.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 65.409999999999997 110.877 -179.93 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.442 ' HE2' ' HG ' ' A' ' 60' ' ' LEU . 2.8 mtm -81.72 -34.75 30.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 64.340000000000003 110.898 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -141.02 76.3 22.46 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.596 0.712 . . . . 75.209999999999994 110.818 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.741 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.3 Cg_endo -69.84 -7.84 22.08 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.707 2.271 . . . . 63.140000000000001 112.303 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.77 -12.37 25.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 55.340000000000003 111.095 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.9 ttmt -84.31 -51.06 7.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.261 -0.427 . . . . 73.150000000000006 110.917 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.552 ' O ' HG12 ' A' ' 69' ' ' VAL . 43.9 m-85 -94.98 23.25 5.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.175 -0.466 . . . . 73.129999999999995 110.935 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.741 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -86.57 -18.16 32.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.103 -0.498 . . . . 75.439999999999998 111.136 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 9.6 p -93.18 -16.07 25.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 71.010000000000005 110.882 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.755 HG21 HD11 ' A' ' 80' ' ' ILE . 9.9 p -51.08 144.36 2.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.118 -0.492 . . . . 72.340000000000003 111.126 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -103.78 86.5 2.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.166 -0.47 . . . . 75.409999999999997 110.844 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.74 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -51.71 -29.95 20.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 75.129999999999995 111.142 -179.887 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -59.41 -47.99 83.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 75.319999999999993 110.905 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -64.05 112.22 2.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 71.409999999999997 110.856 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.66 -26.68 34.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 63.229999999999997 110.877 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -66.33 -49.59 66.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 74.109999999999999 110.921 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -61.74 -56.07 23.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 74.340000000000003 110.931 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.519 ' HA ' HD12 ' A' ' 80' ' ' ILE . 0.5 OUTLIER -55.69 -30.83 27.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 72.409999999999997 111.134 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.3 mtm -67.83 -56.89 7.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 72.129999999999995 110.876 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 44.4 mttt -57.36 -36.3 71.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 72.540000000000006 110.942 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.755 HD11 HG21 ' A' ' 69' ' ' VAL . 24.7 mt -65.72 -51.38 62.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 65.299999999999997 111.116 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.752 HG23 ' HB ' ' A' ' 86' ' ' ILE . 95.9 mt -61.03 -34.79 61.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.13 -0.486 . . . . 75.450000000000003 111.145 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -71.19 -47.29 58.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.476 . . . . 74.319999999999993 110.858 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -66.47 -45.68 78.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.199 -0.455 . . . . 73.219999999999999 110.927 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -73.98 -10.33 59.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.142 -0.481 . . . . 73.420000000000002 110.839 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.36 44.37 18.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.131 -0.486 . . . . 74.239999999999995 110.935 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.752 ' HB ' HG23 ' A' ' 81' ' ' ILE . 16.1 mt -77.25 120.3 81.0 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.597 0.713 . . . . 73.409999999999997 111.16 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.83 166.63 27.04 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.685 2.257 . . . . 72.109999999999999 112.311 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' THR . . . . . 0.533 HG22 ' O ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -90.66 169.96 10.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 74.310000000000002 111.149 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.7 t -51.42 -57.73 2.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.207 -0.451 . . . . 74.010000000000005 111.138 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -51.35 -44.27 62.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.203 -0.453 . . . . 75.230000000000004 110.887 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 71.0 mm-40 -62.19 -46.26 89.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.13 -0.486 . . . . 71.549999999999997 110.952 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -61.13 -40.13 92.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 72.239999999999995 110.951 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -64.15 -51.68 62.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 72.310000000000002 110.929 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -58.84 -39.5 81.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 65.409999999999997 110.883 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -62.7 -53.58 52.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 74.129999999999995 110.891 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.446 . . . . 74.340000000000003 111.166 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' -7' ' ' PHE . . . . . 0.507 ' HB3' HD12 ' A' ' 49' ' ' LEU . 39.4 m-85 . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.844 0.354 . . . . 73.430000000000007 110.888 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 12.8 mm 49.1 78.35 0.41 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.577 0.703 . . . . 70.140000000000001 111.165 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 82.37 0.75 Allowed 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.692 2.261 . . . . 72.409999999999997 112.377 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -90.68 47.84 1.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 71.209999999999994 110.88 -179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' -3' ' ' ARG . . . . . 0.433 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 0.2 OUTLIER -105.13 163.21 17.62 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.645 0.736 . . . . 72.230000000000004 110.851 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' -2' ' ' PRO . . . . . 0.433 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.9 Cg_endo -69.76 -5.98 17.5 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.684 2.256 . . . . 73.540000000000006 112.332 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' -1' ' ' ALA . . . . . 0.418 ' HA ' ' HD2' ' B' ' 0' ' ' PRO . . . 51.22 89.4 0.1 OUTLIER Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.543 0.687 . . . . 75.129999999999995 111.094 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 0' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' B' ' -1' ' ' ALA . 54.1 Cg_endo -69.74 129.63 17.95 Favored 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.705 2.27 . . . . 41.32 112.36 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -70.6 160.44 81.65 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.585 0.707 . . . . 63.149999999999999 110.901 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 166.39 27.79 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.693 2.262 . . . . 74.0 112.353 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--N 1.341 0.166 0 C-N-CA 122.65 2.233 . . . . 63.399999999999999 112.346 179.965 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.5 pp . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.854 0.359 . . . . 63.140000000000001 110.899 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -122.47 163.11 20.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.208 -0.451 . . . . 62.009999999999998 110.884 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' ALA . . . . . 0.434 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -135.02 163.39 29.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 41.420000000000002 111.117 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.475 HG12 HG12 ' A' ' 58' ' ' ILE . 7.5 p -127.43 124.95 64.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 51.100000000000001 111.092 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.766 HG21 HG11 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -68.72 145.67 53.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 55.229999999999997 111.117 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.632 HD11 ' HB2' ' A' ' 56' ' ' ARG . 15.7 mt -114.46 -13.74 12.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 74.25 110.857 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -138.33 170.22 16.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 73.140000000000001 110.931 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -92.68 104.92 17.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 73.200000000000003 110.881 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' PHE . . . . . 0.497 ' HB3' HG12 ' A' ' 20' ' ' VAL . 26.8 t80 -86.9 104.48 16.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 72.310000000000002 110.868 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.8 mttp -80.92 101.03 9.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.127 -0.488 . . . . 72.439999999999998 110.918 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.15 141.76 17.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 74.109999999999999 111.089 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -111.68 -28.76 7.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.203 -0.453 . . . . 71.510000000000005 110.85 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 34.0 mmt180 -127.11 -178.11 4.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 63.109999999999999 110.854 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -66.95 -37.33 84.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 74.209999999999994 110.888 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -67.91 -30.23 69.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 70.299999999999997 110.856 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -81.6 135.03 35.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 71.540000000000006 110.883 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.9 tp -108.11 150.12 27.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.127 -0.488 . . . . 73.329999999999998 110.921 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -91.73 123.26 34.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 62.409999999999997 110.868 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.838 HG21 HD11 ' A' ' 26' ' ' LEU . 9.2 p -133.09 156.63 42.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.201 -0.454 . . . . 73.409999999999997 111.095 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.93 158.55 40.41 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.709 0.766 . . . . 74.109999999999999 110.808 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 118.71 5.85 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.71 2.273 . . . . 64.140000000000001 112.341 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.04 -1.41 38.21 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.721 -0.752 . . . . 74.510000000000005 112.485 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -83.83 162.24 20.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.828 0.347 . . . . 75.239999999999995 110.92 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASN . . . . . 0.418 ' CB ' HD12 ' A' ' 42' ' ' ILE . 6.4 m120 -100.76 132.32 46.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 75.420000000000002 110.847 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.838 HD11 HG21 ' A' ' 20' ' ' VAL . 15.2 mt -129.47 151.71 49.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.106 -0.497 . . . . 74.120000000000005 110.902 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.69 112.82 25.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 74.319999999999993 110.908 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.434 HD11 ' HB2' ' A' ' 4' ' ' ALA . 56.3 mt -80.67 144.44 10.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.141 -0.481 . . . . 75.409999999999997 111.139 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.5 m -117.11 -39.96 3.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.193 -0.458 . . . . 45.520000000000003 110.856 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.543 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -163.28 173.76 12.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.202 -0.454 . . . . 52.32 111.056 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -119.97 177.96 4.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 73.439999999999998 110.819 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.716 ' CE2' HG23 ' B' ' -6' ' ' ILE . 49.8 t80 -148.2 101.17 3.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 71.140000000000001 110.912 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 60.15 18.05 7.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 53.450000000000003 110.862 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.611 ' HD2' HD12 ' A' ' 81' ' ' ILE . 39.1 m-85 61.61 20.62 11.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.23 -0.441 . . . . 75.019999999999996 110.925 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -118.25 -9.33 10.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.11 -0.496 . . . . 51.310000000000002 110.879 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.411 ' HB3' HD21 ' A' ' 49' ' ' LEU . 80.6 m95 -149.23 135.81 19.44 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.15 -0.477 . . . . 74.329999999999998 110.944 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.642 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -116.45 130.23 56.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.237 -0.438 . . . . 75.150000000000006 110.907 -179.964 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.7 mm -83.54 95.1 3.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 61.420000000000002 111.136 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.559 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.87 149.61 30.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 42.43 111.114 179.805 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 pttp -125.04 157.22 67.7 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.555 0.693 . . . . 72.340000000000003 110.935 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 135.97 31.7 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.642 2.228 . . . . 74.439999999999998 112.335 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.418 HD12 ' CB ' ' A' ' 25' ' ' ASN . 57.2 mt . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 71.129999999999995 111.167 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 N--CA 1.466 -0.109 0 CA-C-O 120.863 0.276 . . . . 63.329999999999998 112.318 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.5 -141.93 4.55 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.705 -0.76 . . . . 65.209999999999994 112.485 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.602 HD11 ' HD3' ' B' ' -5' ' ' PRO . 0.7 OUTLIER -146.24 131.26 18.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.828 0.347 . . . . 44.43 110.939 -179.941 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.435 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.5 p -142.41 133.58 12.93 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.606 0.717 . . . . 72.340000000000003 111.196 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.435 ' HD2' HG23 ' A' ' 50' ' ' VAL . 54.0 Cg_endo -69.76 152.69 69.39 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.649 2.233 . . . . 74.109999999999999 112.309 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.793 HG12 ' HB ' ' A' ' 71' ' ' THR . 13.1 t -64.85 -21.75 30.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.467 . . . . 70.109999999999999 111.145 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.4 t -77.09 -3.07 37.37 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.474 . . . . 74.340000000000003 110.863 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -125.09 18.22 8.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 63.439999999999998 110.878 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.583 HG22 ' HA ' ' A' ' 52' ' ' VAL . 13.6 m -148.96 159.86 5.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 72.519999999999996 111.077 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.632 ' HB2' HD11 ' A' ' 7' ' ' LEU . 18.4 ttm180 -127.28 112.31 14.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 75.439999999999998 110.894 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 35.2 mm -64.66 114.14 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.459 . . . . 73.519999999999996 111.11 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.509 HG23 ' HG2' ' A' ' 56' ' ' ARG . 1.5 pt -133.52 137.69 52.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 74.140000000000001 111.177 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -75.13 122.23 23.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.163 -0.471 . . . . 75.439999999999998 110.877 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.4 mt -52.02 -32.79 35.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 73.209999999999994 110.93 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 8.5 mmt -83.06 -29.16 29.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.474 . . . . 75.5 110.845 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -145.3 78.95 11.91 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 121.618 0.723 . . . . 75.030000000000001 110.905 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.752 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.4 Cg_endo -69.78 -7.73 21.82 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.678 2.252 . . . . 73.109999999999999 112.306 -179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.15 -7.89 37.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.258 -0.428 . . . . 63.329999999999998 111.123 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.4 mtpt -84.12 -52.11 6.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 63.420000000000002 110.9 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.615 ' O ' HG12 ' A' ' 69' ' ' VAL . 12.7 m-85 -97.64 23.73 7.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.204 -0.453 . . . . 74.319999999999993 110.941 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.752 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -84.88 -17.06 39.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.088 -0.505 . . . . 33.420000000000002 111.053 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 38.0 m -97.87 -18.36 18.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 61.229999999999997 110.856 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.896 HG21 HD11 ' A' ' 80' ' ' ILE . 7.3 p -51.2 144.84 2.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.105 -0.498 . . . . 75.109999999999999 111.127 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -99.14 87.28 3.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.133 -0.485 . . . . 60.32 110.908 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.793 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -51.92 -34.62 42.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.452 . . . . 73.219999999999999 111.203 -179.875 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -58.22 -45.02 88.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 75.129999999999995 110.937 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -63.5 109.14 1.54 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.115 -0.493 . . . . 73.519999999999996 110.921 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.61 -26.24 31.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 60.109999999999999 110.868 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -67.01 -52.85 37.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 73.129999999999995 110.895 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -60.99 -56.42 21.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 72.409999999999997 110.931 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.576 HG21 HG11 ' A' ' 52' ' ' VAL . 1.5 p -53.7 -31.49 20.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.464 . . . . 73.299999999999997 111.135 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 12.3 mtm -68.06 -56.54 8.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.461 . . . . 75.219999999999999 110.86 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.1 mttt -55.05 -37.42 66.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.19 -0.459 . . . . 75.420000000000002 110.891 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.896 HD11 HG21 ' A' ' 69' ' ' VAL . 48.0 mt -66.32 -52.67 44.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.431 . . . . 73.409999999999997 111.157 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.733 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.5 mt -61.96 -35.8 70.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 72.310000000000002 111.133 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -69.9 -47.66 61.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.139 -0.482 . . . . 45.219999999999999 110.853 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -64.25 -49.25 72.65 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 75.540000000000006 110.883 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -68.04 -14.71 63.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 73.329999999999998 110.907 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.5 mmtp 60.46 55.81 3.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 72.420000000000002 110.941 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.733 ' HB ' HG23 ' A' ' 81' ' ' ILE . 31.4 mt -88.41 126.09 61.45 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.623 0.725 . . . . 70.299999999999997 111.159 179.848 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.543 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 54.1 Cg_endo -69.73 163.8 36.9 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.709 2.273 . . . . 64.040000000000006 112.361 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.95 172.11 8.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 62.200000000000003 111.132 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' VAL . . . . . 0.413 HG23 ' HB2' ' A' ' 32' ' ' TYR . 88.2 t -51.34 -54.31 12.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.451 . . . . 74.319999999999993 111.117 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -50.5 -47.5 57.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 73.349999999999994 110.888 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 45.4 mm-40 -62.96 -41.89 99.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.096 -0.502 . . . . 72.120000000000005 110.899 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 24.2 t90 -65.19 -39.99 93.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.2 -0.454 . . . . 74.230000000000004 110.94 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.82 -49.54 70.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.276 -0.42 . . . . 70.510000000000005 110.916 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -63.16 -37.73 88.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 71.129999999999995 110.89 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -63.49 -52.04 63.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 73.239999999999995 110.915 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.171 -0.468 . . . . 72.340000000000003 111.117 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.848 0.356 . . . . 65.519999999999996 110.87 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' -6' ' ' ILE . . . . . 0.716 HG23 ' CE2' ' A' ' 32' ' ' TYR . 58.1 mt 45.46 84.47 0.19 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.638 0.732 . . . . 75.319999999999993 111.099 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' -5' ' ' PRO . . . . . 0.602 ' HD3' HD11 ' A' ' 49' ' ' LEU . 53.8 Cg_endo -69.79 127.51 14.67 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.666 2.244 . . . . 64.209999999999994 112.339 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -114.03 0.73 14.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.239 -0.437 . . . . 75.510000000000005 110.874 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -50.63 163.82 0.45 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.635 0.731 . . . . 64.129999999999995 110.849 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -16.22 37.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.651 2.234 . . . . 53.100000000000001 112.377 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.1 84.65 0.18 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.549 0.69 . . . . 70.329999999999998 111.12 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 138.02 36.94 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.679 2.253 . . . . 65.420000000000002 112.351 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -71.4 160.69 81.81 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.572 0.701 . . . . 73.310000000000002 110.895 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 167.6 24.0 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.635 2.223 . . . . 64.549999999999997 112.33 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 C--N 1.342 0.192 0 C-N-CA 122.66 2.24 . . . . 65.510000000000005 112.382 179.934 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' LEU . . . . . 0.649 HD11 HG13 ' A' ' 28' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.861 0.362 . . . . 75.129999999999995 110.907 . . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.699 ' CG ' HD23 ' A' ' 60' ' ' LEU . 50.1 m-85 -129.8 161.49 30.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 71.010000000000005 110.874 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -136.39 161.64 35.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 72.299999999999997 111.09 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.463 HG12 HG12 ' A' ' 58' ' ' ILE . 8.7 p -130.76 128.07 62.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.466 . . . . 64.310000000000002 111.104 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' THR . . . . . 0.734 HG21 HG11 ' A' ' 20' ' ' VAL . 0.6 OUTLIER -74.32 139.63 44.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.173 -0.467 . . . . 73.200000000000003 111.153 179.988 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LEU . . . . . 0.792 HD11 ' HB2' ' A' ' 56' ' ' ARG . 9.9 mt -114.9 -15.4 11.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 75.0 110.866 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -135.07 158.2 44.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 74.310000000000002 110.918 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -84.38 105.14 14.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.088 -0.506 . . . . 74.400000000000006 110.878 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -88.31 117.98 27.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 71.409999999999997 110.915 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.7 mttt -93.47 113.18 25.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 71.530000000000001 110.845 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ALA . . . . . 0.687 ' HB1' ' HB2' ' A' ' 17' ' ' GLU . . . -66.36 156.71 33.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 73.510000000000005 111.099 179.78 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -115.66 -28.55 6.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 73.099999999999994 110.867 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.6 mmm180 -133.09 174.55 10.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 74.530000000000001 110.856 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -58.85 -40.99 85.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 73.329999999999998 110.877 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -60.32 -25.89 66.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.172 -0.467 . . . . 71.310000000000002 110.871 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.687 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 5.9 mm-40 -87.62 139.41 30.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.452 . . . . 74.200000000000003 110.908 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tp -116.11 123.27 47.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.182 -0.463 . . . . 44.030000000000001 110.913 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -74.26 145.73 43.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.184 -0.462 . . . . 71.140000000000001 110.874 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.774 HG21 HD11 ' A' ' 26' ' ' LEU . 9.9 p -147.35 156.78 10.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.232 -0.44 . . . . 72.329999999999998 111.136 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -113.2 158.45 38.11 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.649 0.738 . . . . 63.450000000000003 110.855 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 125.32 12.02 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.681 2.254 . . . . 62.520000000000003 112.358 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.16 -6.84 32.49 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.717 -0.754 . . . . 63.43 112.496 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -87.74 143.99 26.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.855 0.36 . . . . 70.340000000000003 110.882 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -97.07 120.56 37.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 65.319999999999993 110.915 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' LEU . . . . . 0.774 HD11 HG21 ' A' ' 20' ' ' VAL . 2.9 mp -111.89 157.44 20.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 72.219999999999999 110.873 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.33 112.85 25.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 74.409999999999997 110.836 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ILE . . . . . 0.649 HG13 HD11 ' A' ' 2' ' ' LEU . 29.7 mm -69.68 143.5 14.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 73.420000000000002 111.097 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.5 m -121.4 -39.7 2.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.15 -0.477 . . . . 74.219999999999999 110.925 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.416 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -173.89 173.43 3.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.474 . . . . 72.010000000000005 111.105 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -120.87 176.19 5.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 63.409999999999997 110.876 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' TYR . . . . . 0.747 ' OH ' HG23 ' B' ' -6' ' ' ILE . 29.7 t80 -146.59 101.01 3.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.198 -0.455 . . . . 72.109999999999999 110.941 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ASP . . . . . 0.42 ' HB3' ' CG ' ' A' ' 35' ' ' GLU . 38.0 t0 61.44 16.45 7.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 64.530000000000001 110.903 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.613 ' HD2' HD12 ' A' ' 81' ' ' ILE . 40.6 m-85 63.76 30.06 14.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 72.140000000000001 110.908 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.42 ' CG ' ' HB3' ' A' ' 33' ' ' ASP . 3.6 pt-20 -132.21 -1.57 3.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.158 -0.474 . . . . 72.439999999999998 110.906 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.556 ' HB3' HD21 ' A' ' 49' ' ' LEU . 85.5 m95 -152.75 135.46 15.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.155 -0.475 . . . . 74.420000000000002 110.938 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' PHE . . . . . 0.527 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -121.72 139.0 54.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.289 -0.414 . . . . 72.209999999999994 110.886 -179.991 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 12.9 mm -93.31 94.79 4.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.126 -0.488 . . . . 72.129999999999995 111.131 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ALA . . . . . 0.765 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -108.75 134.87 50.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.466 . . . . 75.219999999999999 111.135 179.801 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.64 156.53 39.52 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.555 0.693 . . . . 74.299999999999997 110.914 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 124.17 10.84 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.691 2.261 . . . . 75.239999999999995 112.33 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 46.8 mt . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.276 -0.42 . . . . 65.099999999999994 111.102 179.906 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.466 -0.12 0 CA-C-O 120.823 0.259 . . . . 72.450000000000003 112.312 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.22 -158.01 8.38 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.752 -0.737 . . . . 64.430000000000007 112.55 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.556 HD21 ' HB3' ' A' ' 36' ' ' TRP . 1.0 OUTLIER -124.92 125.01 43.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.89 0.376 . . . . 71.209999999999994 110.915 -179.933 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 50' ' ' VAL . . . . . 0.5 HG11 ' HB3' ' A' ' 39' ' ' ALA . 7.4 p -131.11 133.74 25.03 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-O 121.626 0.727 . . . . 71.200000000000003 111.12 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' PRO . . . . . 0.461 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.9 Cg_endo -69.73 153.19 69.36 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.669 2.246 . . . . 72.439999999999998 112.365 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.814 HG12 ' HB ' ' A' ' 71' ' ' THR . 4.6 t -74.39 -21.14 17.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 71.349999999999994 111.151 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.9 m -76.59 -3.28 36.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 74.420000000000002 110.852 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -125.97 21.29 7.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.148 -0.478 . . . . 73.420000000000002 110.946 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' VAL . . . . . 0.625 HG22 ' HA ' ' A' ' 52' ' ' VAL . 10.4 m -148.87 167.0 3.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.086 -0.506 . . . . 52.539999999999999 111.146 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.792 ' HB2' HD11 ' A' ' 7' ' ' LEU . 39.8 ttm-85 -138.35 119.68 14.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 64.040000000000006 110.811 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 38.8 mm -70.29 108.8 2.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.183 -0.462 . . . . 64.409999999999997 111.154 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ILE . . . . . 0.497 HG23 ' HG2' ' A' ' 56' ' ' ARG . 2.2 pt -128.31 140.3 49.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.459 . . . . 72.420000000000002 111.122 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -78.76 121.91 25.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.187 -0.46 . . . . 74.530000000000001 110.848 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.699 HD23 ' CG ' ' A' ' 3' ' ' PHE . 0.2 OUTLIER -53.5 -30.02 39.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.157 -0.474 . . . . 72.230000000000004 110.892 -179.976 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.404 ' HE3' ' HB3' ' A' ' 60' ' ' LEU . 14.3 mmt -85.36 -26.07 26.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 73.439999999999998 110.865 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -148.95 77.72 9.14 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.665 0.745 . . . . 64.409999999999997 110.884 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' PRO . . . . . 0.737 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 54.1 Cg_endo -69.7 -7.95 22.35 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.696 2.264 . . . . 72.200000000000003 112.376 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.42 -5.98 45.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.203 -0.453 . . . . 71.310000000000002 111.15 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -84.03 -41.49 17.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 65.420000000000002 110.867 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' TYR . . . . . 0.677 ' O ' HG12 ' A' ' 69' ' ' VAL . 23.4 m-85 -111.72 23.67 13.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.213 -0.449 . . . . 73.200000000000003 110.957 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ALA . . . . . 0.737 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -81.34 -13.4 58.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.09 -0.505 . . . . 73.230000000000004 111.13 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.4 t -102.85 -22.22 13.91 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 64.150000000000006 110.825 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' VAL . . . . . 0.943 HG21 HD11 ' A' ' 80' ' ' ILE . 9.9 p -51.18 156.61 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.108 -0.496 . . . . 73.25 111.097 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -114.25 107.43 15.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 65.530000000000001 110.867 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.814 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -70.8 -25.8 63.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.153 -0.476 . . . . 42.219999999999999 111.145 -179.879 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -62.97 -47.67 82.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.225 -0.443 . . . . 72.329999999999998 110.918 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -63.83 110.16 1.99 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.136 -0.484 . . . . 65.299999999999997 110.87 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.31 -27.61 24.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 73.25 110.855 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -66.96 -54.36 22.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.445 . . . . 52.049999999999997 110.87 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -59.77 -55.75 30.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 74.340000000000003 110.878 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' VAL . . . . . 0.528 ' HA ' HD12 ' A' ' 80' ' ' ILE . 5.4 p -54.05 -32.81 23.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.209 -0.451 . . . . 62.539999999999999 111.168 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 15.0 mtm -67.15 -53.83 26.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.128 -0.487 . . . . 74.310000000000002 110.872 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.0 mttm -56.52 -38.37 71.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 74.209999999999994 110.891 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.943 HD11 HG21 ' A' ' 69' ' ' VAL . 16.5 mt -65.29 -52.95 45.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.456 . . . . 65.319999999999993 111.088 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 81' ' ' ILE . . . . . 0.788 HG23 ' HB ' ' A' ' 86' ' ' ILE . 94.7 mt -62.01 -36.48 74.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 64.510000000000005 111.151 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -70.19 -46.78 63.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.147 -0.479 . . . . 72.310000000000002 110.804 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -63.53 -53.64 48.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 61.210000000000001 110.878 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.2 m-85 -68.03 -14.8 63.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.132 -0.486 . . . . 74.329999999999998 110.85 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 28.6 mmtm 60.78 55.49 3.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 72.129999999999995 110.93 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' ILE . . . . . 0.788 ' HB ' HG23 ' A' ' 81' ' ' ILE . 36.0 mt -82.5 131.98 53.72 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.601 0.715 . . . . 64.540000000000006 111.193 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 87' ' ' PRO . . . . . 0.416 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 53.4 Cg_endo -69.78 166.94 25.93 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.665 2.244 . . . . 65.540000000000006 112.316 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -97.33 168.01 10.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 73.310000000000002 111.154 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.2 t -51.41 -54.91 9.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 74.519999999999996 111.129 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -51.65 -52.06 50.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 74.120000000000005 110.846 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -57.02 -42.44 80.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 72.439999999999998 110.898 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -62.2 -39.39 92.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.218 -0.446 . . . . 74.329999999999998 110.932 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -65.12 -53.37 46.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.223 -0.444 . . . . 75.150000000000006 110.868 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -59.06 -37.23 76.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 43.409999999999997 110.872 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -64.4 -54.42 33.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 75.319999999999993 110.94 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.208 -0.451 . . . . 70.530000000000001 111.171 -179.945 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.845 0.355 . . . . 74.019999999999996 110.886 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' -6' ' ' ILE . . . . . 0.747 HG23 ' OH ' ' A' ' 32' ' ' TYR . 3.9 mp 51.67 82.02 0.25 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.579 0.704 . . . . 71.25 111.163 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.71 117.88 5.35 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.649 2.232 . . . . 74.140000000000001 112.388 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 30.5 t -107.02 5.06 27.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.246 -0.433 . . . . 64.510000000000005 110.84 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 2.0 mpp_? -51.62 162.72 0.69 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.567 0.698 . . . . 73.140000000000001 110.888 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 -11.19 30.31 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.642 2.228 . . . . 71.109999999999999 112.32 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 63.82 82.3 0.21 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.611 0.719 . . . . 73.310000000000002 111.083 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 141.18 44.47 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.663 2.242 . . . . 73.239999999999995 112.332 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 22.1 mtmm -86.81 159.61 51.66 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.578 0.704 . . . . 65.099999999999994 110.89 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 166.9 26.04 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.658 2.239 . . . . 74.430000000000007 112.383 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--N 1.342 0.197 0 C-N-CA 122.696 2.264 . . . . 73.219999999999999 112.343 179.974 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 1.1 ptt? . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.797 0.332 . . . . 62.439999999999998 110.87 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' -1' ' ' ALA . . . . . 0.568 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -97.79 160.22 29.07 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.619 0.723 . . . . 50.229999999999997 111.079 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.568 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 54.5 Cg_endo -69.7 79.31 0.93 Allowed 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 122.675 2.25 . . . . 62.140000000000001 112.372 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.738 HD11 HG13 ' A' ' 28' ' ' ILE . 0.5 OUTLIER -76.7 156.16 32.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.451 . . . . 74.150000000000006 110.926 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.475 ' CE1' HD11 ' A' ' 60' ' ' LEU . 20.5 m-85 -133.22 146.11 51.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 73.409999999999997 110.949 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -122.56 153.47 39.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.187 -0.46 . . . . 61.0 111.103 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 24' ' ' GLU . 7.5 p -123.27 130.22 74.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.21 -0.45 . . . . 65.310000000000002 111.118 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.58 HG21 ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -72.26 138.17 47.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 52.229999999999997 111.182 -179.98 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.725 HD11 ' HB2' ' A' ' 56' ' ' ARG . 13.4 mt -112.44 -12.02 13.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.254 -0.43 . . . . 74.230000000000004 110.95 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -137.69 154.81 49.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.185 -0.461 . . . . 74.230000000000004 110.931 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -81.94 104.73 12.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.127 -0.488 . . . . 71.409999999999997 110.893 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -109.61 102.87 11.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 73.310000000000002 110.845 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -78.99 136.32 37.18 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 70.120000000000005 110.88 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.32 161.2 11.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 63.130000000000003 111.102 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -124.6 -36.47 2.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 44.119999999999997 110.936 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -132.45 -177.88 4.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 74.319999999999993 110.886 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -65.67 -15.12 62.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.221 -0.445 . . . . 74.0 110.886 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -99.03 22.34 10.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 64.430000000000007 110.878 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.0 mp0 -136.87 142.85 42.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 73.349999999999994 110.843 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.551 HD11 HH12 ' A' ' 43' B ARG . 5.5 tp -121.36 126.45 49.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.145 -0.48 . . . . 61.439999999999998 110.946 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -65.5 139.96 58.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.457 . . . . 73.439999999999998 110.83 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.58 ' HB ' HG21 ' A' ' 6' ' ' THR . 0.4 OUTLIER -142.47 158.44 19.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 63.409999999999997 111.17 179.965 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -127.17 159.85 62.87 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.649 0.738 . . . . 61.310000000000002 110.83 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 117.78 5.29 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.659 2.239 . . . . 72.239999999999995 112.373 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.5 7.12 30.47 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.718 -0.753 . . . . 44.450000000000003 112.448 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.557 ' O ' HG23 ' A' ' 5' ' ' VAL . 22.2 mm-40 -91.91 162.49 14.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.857 0.36 . . . . 74.129999999999995 110.908 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -107.96 119.42 39.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 74.040000000000006 110.897 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.778 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 5.5 mt -120.98 154.29 36.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.195 -0.457 . . . . 73.25 110.946 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -109.03 115.94 31.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 65.329999999999998 110.844 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.738 HG13 HD11 ' A' ' 2' ' ' LEU . 35.4 mm -70.57 143.32 14.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.476 . . . . 53.530000000000001 111.149 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.9 m -124.5 -37.13 2.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 71.230000000000004 110.887 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -168.87 170.62 9.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 40.539999999999999 111.093 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -123.89 174.51 7.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 73.340000000000003 110.873 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -142.16 100.68 3.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 75.239999999999995 110.896 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 60.09 18.78 8.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.075 -0.511 . . . . 63.439999999999998 110.87 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.616 ' HD2' HD12 ' A' ' 81' ' ' ILE . 36.4 m-85 65.45 23.95 11.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.218 -0.446 . . . . 75.150000000000006 110.942 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.492 ' O ' HG23 ' A' ' 52' ' ' VAL . 0.4 OUTLIER -116.92 -41.31 3.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.098 -0.501 . . . . 74.299999999999997 110.866 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.426 ' CD1' ' HB2' ' A' ' 35' ' ' GLU . 56.6 m95 -116.62 140.32 49.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.185 -0.461 . . . . 74.439999999999998 110.926 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.613 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -119.31 142.8 47.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 52.130000000000003 110.873 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 23.5 mm -96.27 95.44 4.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 71.549999999999997 111.103 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.778 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -109.06 136.38 48.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 60.409999999999997 111.099 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.8 pttt -111.46 157.73 38.31 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.621 0.724 . . . . 74.230000000000004 110.908 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 135.53 30.58 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.701 2.268 . . . . 64.409999999999997 112.367 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 79.3 mt -108.11 -39.36 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.26 -0.427 . . . . 75.519999999999996 111.152 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' A ASN . . . . . . . . . . . . . 9.4 m-80 -72.82 -69.1 0.43 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 73.010000000000005 110.922 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' B ARG . . . . . 0.551 HH12 HD11 ' A' ' 18' ' ' LEU . 16.7 ptt85 -80.05 178.79 7.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 70.030000000000001 110.863 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 44' ' ' LEU . 12.1 mt -125.36 121.47 34.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 74.510000000000005 110.865 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -157.2 -71.62 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.688 -0.768 . . . . 42.520000000000003 112.477 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 167.76 165.32 24.96 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.752 -0.737 . . . . 23.120000000000001 112.486 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.83 147.63 62.84 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.642 2.228 . . . . 73.299999999999997 112.327 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.22 -143.29 4.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.771 -0.728 . . . . 54.140000000000001 112.504 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.412 HD11 ' HD3' ' B' ' -5' ' ' PRO . 0.2 OUTLIER -146.17 124.86 12.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.893 0.378 . . . . 61.100000000000001 110.899 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.442 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.3 p -136.18 133.87 19.82 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.635 0.731 . . . . 74.219999999999999 111.14 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.442 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.8 Cg_endo -69.76 153.18 69.22 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.664 2.243 . . . . 72.239999999999995 112.352 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.782 HG12 ' HB ' ' A' ' 71' ' ' THR . 11.1 t -66.34 -21.74 29.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.245 -0.434 . . . . 72.219999999999999 111.164 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.1 m -77.94 -1.93 34.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.154 -0.475 . . . . 72.310000000000002 110.871 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -126.84 22.91 6.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.137 -0.483 . . . . 73.109999999999999 110.934 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.559 HG22 ' HA ' ' A' ' 52' ' ' VAL . 16.8 m -150.23 165.18 3.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.1 -0.5 . . . . 74.510000000000005 111.181 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.725 ' HB2' HD11 ' A' ' 7' ' ' LEU . 40.0 ttp85 -133.5 114.02 13.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.233 -0.44 . . . . 74.510000000000005 110.865 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 29.1 mm -69.37 127.34 31.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 74.319999999999993 111.129 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.444 HG21 ' NH1' ' A' ' 56' ' ' ARG . 24.7 pt -143.49 -178.22 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 73.409999999999997 111.132 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -131.44 132.67 44.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.467 . . . . 62.119999999999997 110.838 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.475 HD11 ' CE1' ' A' ' 3' ' ' PHE . 57.6 mt -59.28 -21.84 60.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 73.430000000000007 110.974 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.1 mtm -90.04 -30.21 17.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.14 -0.482 . . . . 74.219999999999999 110.903 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -152.19 75.69 7.27 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.584 0.707 . . . . 74.450000000000003 110.855 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.713 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.3 Cg_endo -69.82 -11.12 30.11 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.64 2.226 . . . . 74.099999999999994 112.308 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.07 -5.56 47.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.241 -0.436 . . . . 65.219999999999999 111.107 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.3 ttmm -83.06 -51.12 7.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 63.109999999999999 110.916 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.614 ' O ' HG12 ' A' ' 69' ' ' VAL . 88.6 m-85 -99.76 23.23 9.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.232 -0.44 . . . . 64.340000000000003 110.921 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.713 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -87.03 -20.88 26.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.484 . . . . 65.439999999999998 111.118 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.0 t -92.85 -21.06 20.09 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.2 -0.455 . . . . 72.430000000000007 110.865 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 1.052 HG21 HD11 ' A' ' 80' ' ' ILE . 7.6 p -51.55 152.27 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.495 . . . . 72.340000000000003 111.151 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -104.18 91.33 3.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 42.25 110.903 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.782 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -51.6 -35.66 42.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 73.329999999999998 111.136 -179.864 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -58.02 -43.98 87.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.221 -0.445 . . . . 72.0 110.969 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -63.83 107.98 1.35 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.094 -0.503 . . . . 61.009999999999998 110.846 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.28 -28.46 19.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 75.540000000000006 110.851 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -66.73 -55.0 17.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 63.240000000000002 110.896 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -59.58 -56.35 23.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 74.209999999999994 110.891 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.401 HG21 HG11 ' A' ' 52' ' ' VAL . 4.2 p -53.44 -32.34 20.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 74.409999999999997 111.152 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 9.8 mtm -67.41 -54.51 19.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 61.119999999999997 110.879 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.83 -37.91 69.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.263 -0.426 . . . . 71.099999999999994 110.863 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 1.052 HD11 HG21 ' A' ' 69' ' ' VAL . 84.4 mt -66.12 -53.46 36.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 71.129999999999995 111.155 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.76 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.4 mt -61.86 -36.21 72.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.459 . . . . 73.230000000000004 111.124 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 61.1 t0 -71.05 -48.26 53.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 51.299999999999997 110.864 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -60.88 -53.89 51.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 73.439999999999998 110.896 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -69.21 -11.96 61.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.475 . . . . 70.310000000000002 110.9 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt 58.45 54.53 5.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 72.430000000000007 110.872 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.76 ' HB ' HG23 ' A' ' 81' ' ' ILE . 20.5 mt -81.06 131.61 59.08 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.638 0.733 . . . . 72.450000000000003 111.094 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 159.04 54.84 Favored 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.675 2.25 . . . . 64.049999999999997 112.384 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -92.84 170.0 10.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 73.010000000000005 111.188 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.692 HG11 ' O ' ' B' ' -7' ' ' PHE . 98.4 t -52.04 -58.07 2.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.28 -0.418 . . . . 65.239999999999995 111.074 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -51.54 -51.86 51.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.451 . . . . 64.109999999999999 110.881 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 51.5 mm-40 -57.23 -38.56 73.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.136 -0.484 . . . . 64.409999999999997 110.971 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 24.2 t90 -66.39 -43.3 86.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.169 -0.469 . . . . 63.299999999999997 110.929 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -61.54 -47.92 83.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 44.409999999999997 110.927 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -64.69 -39.93 94.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.436 . . . . 73.230000000000004 110.886 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -60.39 -49.24 78.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.454 . . . . 74.430000000000007 110.94 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -66.07 -41.84 90.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.444 . . . . 75.040000000000006 111.121 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -59.81 -48.62 80.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 73.209999999999994 110.865 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 12.2 ptp180 -72.11 -32.63 67.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 54.43 110.848 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -67.65 -33.93 75.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 71.010000000000005 110.904 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 12.6 mmmt -73.82 -25.65 60.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.137 -0.483 . . . . 73.219999999999999 110.938 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -63.43 179.24 0.46 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 70.019999999999996 110.881 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 24.2 m -87.15 120.73 28.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 73.150000000000006 110.864 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 51.7 p -165.29 -174.53 3.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.126 -0.488 . . . . 70.209999999999994 110.843 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 23.4 mm -67.23 150.25 11.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.133 -0.485 . . . . 63.030000000000001 111.137 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.601 ' O ' HD13 ' A' ' 106' ' ' ILE . 9.2 pt20 -173.96 -178.83 1.59 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 75.019999999999996 110.899 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.601 HD13 ' O ' ' A' ' 105' ' ' GLN . 28.7 mm -127.09 127.24 69.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 71.340000000000003 111.149 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -71.95 -34.12 62.21 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.715 -0.755 . . . . 62.210000000000001 112.48 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -59.71 139.68 57.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.887 0.375 . . . . 74.530000000000001 110.882 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 131.98 124.12 2.53 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.754 -0.736 . . . . 32.229999999999997 112.507 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -139.99 133.42 30.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.798 0.332 . . . . 74.420000000000002 110.875 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -131.44 154.57 20.94 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.672 -0.775 . . . . 51.509999999999998 112.477 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -148.68 171.73 15.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.811 0.338 . . . . 72.319999999999993 110.932 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 74.1 m -106.39 144.14 33.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 73.439999999999998 110.825 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 74.3 mm-40 -65.03 177.26 1.03 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.123 -0.49 . . . . 73.540000000000006 110.899 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -176.52 109.37 0.28 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.769 -0.729 . . . . 43.340000000000003 112.512 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 27.9 mt -130.34 162.83 28.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.75 0.31 . . . . 72.200000000000003 110.944 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 74.329999999999998 110.885 179.91 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 N-CA-C 112.498 -0.241 . . . . 73.329999999999998 112.498 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 63.89 26.99 14.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.801 0.334 . . . . 63.240000000000002 110.913 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' -7' ' ' PHE . . . . . 0.692 ' O ' HG11 ' A' ' 89' ' ' VAL . 38.8 m-85 -137.45 56.82 1.76 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 53.030000000000001 110.891 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 26.7 mm -110.82 81.64 2.65 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.631 0.729 . . . . 71.530000000000001 111.087 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' -5' ' ' PRO . . . . . 0.412 ' HD3' HD11 ' A' ' 49' ' ' LEU . 54.2 Cg_endo -69.74 78.46 1.0 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.667 2.245 . . . . 74.420000000000002 112.333 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 29.7 m -82.5 0.31 43.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.254 -0.43 . . . . 71.030000000000001 110.857 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 2.1 mpp_? -67.63 162.17 59.57 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.552 0.692 . . . . 64.140000000000001 110.864 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 158.88 55.48 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.651 2.234 . . . . 55.450000000000003 112.411 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -91.37 111.94 51.51 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.55 0.69 . . . . 72.120000000000005 111.101 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 149.84 67.23 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.65 2.233 . . . . 70.010000000000005 112.355 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 17.0 mtmt -99.89 161.18 25.18 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.598 0.713 . . . . 73.209999999999994 110.913 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 168.25 22.07 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.7 2.267 . . . . 55.109999999999999 112.336 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 87.82 0.55 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.627 2.218 . . . . 71.140000000000001 112.368 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 26.2 p -153.85 157.82 39.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 63.229999999999997 110.882 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 55.9 m -83.87 97.92 9.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 75.420000000000002 110.88 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.097 -0.501 . . . . 75.040000000000006 111.096 179.944 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 7.4 ptm . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.804 0.335 . . . . 72.329999999999998 110.85 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' -1' ' ' ALA . . . . . 0.435 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -131.8 156.22 80.39 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.573 0.702 . . . . 72.439999999999998 111.092 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.435 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 54.0 Cg_endo -69.72 77.46 1.06 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.681 2.254 . . . . 63.030000000000001 112.34 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.519 HD23 ' H ' ' A' ' 2' ' ' LEU . 1.3 pt? -72.94 145.03 47.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.247 -0.433 . . . . 75.219999999999999 110.917 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.72 ' CD1' HD23 ' A' ' 60' ' ' LEU . 63.8 m-85 -115.26 153.68 30.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.178 -0.464 . . . . 62.399999999999999 110.892 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -129.47 152.88 48.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 72.030000000000001 111.14 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.453 HG13 ' HB3' ' A' ' 56' ' ' ARG . 6.1 p -120.49 125.65 74.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.261 -0.427 . . . . 51.100000000000001 111.127 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.725 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -66.95 131.39 45.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 75.049999999999997 111.105 -179.936 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.616 HD11 ' HB2' ' A' ' 56' ' ' ARG . 71.3 mt -102.36 -17.87 15.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 75.439999999999998 110.918 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -133.96 157.14 46.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 75.540000000000006 110.963 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -82.55 105.28 13.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 74.209999999999994 110.878 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -84.64 105.05 15.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.117 -0.492 . . . . 72.219999999999999 110.88 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.5 mttp -81.22 97.82 7.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 74.140000000000001 110.871 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.36 140.35 22.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 54.509999999999998 111.106 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -107.06 -28.86 9.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 63.340000000000003 110.89 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -129.77 -179.25 5.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.466 . . . . 70.439999999999998 110.868 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -65.02 -36.9 85.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 70.209999999999994 110.859 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -63.25 -34.91 78.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.167 -0.47 . . . . 70.140000000000001 110.88 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -77.16 140.7 40.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.179 -0.464 . . . . 72.129999999999995 110.922 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 12.3 tp -112.54 127.2 56.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.155 -0.475 . . . . 74.049999999999997 110.937 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 -72.89 125.22 27.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.247 -0.433 . . . . 74.319999999999993 110.838 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.725 ' CG1' HG21 ' A' ' 6' ' ' THR . 10.1 p -138.78 152.65 24.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 74.230000000000004 111.106 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -114.41 159.64 35.98 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.673 0.749 . . . . 74.340000000000003 110.859 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 123.18 9.83 Favored 'Trans proline' 0 C--N 1.341 0.143 0 C-N-CA 122.672 2.248 . . . . 73.129999999999995 112.346 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.09 4.53 31.12 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.696 -0.764 . . . . 60.439999999999998 112.47 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.407 ' O ' HG23 ' A' ' 5' ' ' VAL . 23.3 mm-40 -92.01 165.1 13.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.842 0.353 . . . . 72.150000000000006 110.91 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.654 ' HB3' HD12 ' A' ' 42' ' ' ILE . 7.9 m120 -110.75 128.37 55.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.151 -0.477 . . . . 72.219999999999999 110.915 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.74 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 2.1 mt -128.24 146.48 50.72 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.188 -0.46 . . . . 71.420000000000002 110.902 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.25 123.26 39.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 74.219999999999999 110.891 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 34.3 mm -70.12 144.49 13.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.468 . . . . 63.420000000000002 111.146 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 21.8 m -125.77 -37.48 2.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 74.329999999999998 110.879 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -179.11 171.54 1.34 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 41.539999999999999 111.121 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.549 ' O ' HG22 ' A' ' 88' ' ' THR . 2.7 p80 -124.25 176.85 6.16 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 71.439999999999998 110.876 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.402 ' HB3' ' HB2' ' A' ' 36' ' ' TRP . 29.5 t80 -148.03 102.78 3.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 73.310000000000002 110.942 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 60.16 18.64 8.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.139 -0.482 . . . . 74.540000000000006 110.883 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.605 ' HD2' HD12 ' A' ' 81' ' ' ILE . 44.2 m-85 61.79 20.23 11.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 75.299999999999997 110.922 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -119.47 -3.81 10.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.113 -0.494 . . . . 64.400000000000006 110.863 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.512 ' HB3' HD21 ' A' ' 49' ' ' LEU . 90.5 m95 -151.57 135.8 16.74 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.148 -0.478 . . . . 75.010000000000005 110.893 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.6 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -120.06 145.64 46.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.231 -0.44 . . . . 70.439999999999998 110.887 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.8 mm -100.83 95.12 3.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.122 -0.49 . . . . 75.140000000000001 111.119 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.74 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.18 134.91 51.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.469 . . . . 71.340000000000003 111.107 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.8 pttt -111.34 156.75 40.68 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.59 0.71 . . . . 73.200000000000003 110.885 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 115.44 4.1 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.722 2.281 . . . . 73.540000000000006 112.313 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.654 HD12 ' HB3' ' A' ' 25' ' ' ASN . 55.1 mt -72.35 -34.72 49.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 52.399999999999999 111.142 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' A ASN . . . . . . . . . . . . . 8.5 t30 -89.22 -57.01 3.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.148 -0.478 . . . . 74.430000000000007 110.886 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' B ARG . . . . . . . . . . . . . 27.8 mtm-85 -67.55 149.01 50.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 74.420000000000002 110.86 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.07 12.42 32.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.181 -0.463 . . . . 70.319999999999993 110.927 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -51.79 -86.37 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.737 -0.744 . . . . 54.310000000000002 112.462 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -179.46 165.71 34.59 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.773 -0.727 . . . . 61.009999999999998 112.502 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 146.07 58.89 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.658 2.239 . . . . 64.140000000000001 112.31 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -133.68 -156.8 8.09 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.744 -0.741 . . . . 41.229999999999997 112.496 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.512 HD21 ' HB3' ' A' ' 36' ' ' TRP . 1.7 tt -131.11 124.86 31.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.797 0.332 . . . . 61.350000000000001 110.953 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.442 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.3 p -137.23 133.46 18.37 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.613 0.72 . . . . 72.450000000000003 111.13 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.442 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.7 Cg_endo -69.75 155.63 65.46 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.644 2.23 . . . . 63.100000000000001 112.341 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.801 HG12 ' HB ' ' A' ' 71' ' ' THR . 9.4 t -68.39 -21.44 26.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.45 . . . . 74.430000000000007 111.134 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -77.24 -3.06 37.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.152 -0.476 . . . . 63.229999999999997 110.837 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -124.89 19.91 8.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.131 -0.486 . . . . 73.150000000000006 110.882 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.571 HG22 ' HA ' ' A' ' 52' ' ' VAL . 17.0 m -150.24 157.41 6.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.111 -0.495 . . . . 54.100000000000001 111.094 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.616 ' HB2' HD11 ' A' ' 7' ' ' LEU . 22.4 ttp180 -123.93 110.77 15.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 72.109999999999999 110.853 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.502 HG21 HG21 ' A' ' 80' ' ' ILE . 38.9 mm -64.69 121.37 13.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 60.409999999999997 111.135 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.423 HG23 ' HG2' ' A' ' 56' ' ' ARG . 14.8 pt -136.18 173.41 13.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.172 -0.467 . . . . 73.120000000000005 111.16 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -115.92 126.33 53.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 74.510000000000005 110.839 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.72 HD23 ' CD1' ' A' ' 3' ' ' PHE . 0.2 OUTLIER -52.49 -29.34 24.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 74.310000000000002 110.95 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.82 -26.01 19.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.216 -0.447 . . . . 73.420000000000002 110.9 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -141.61 73.76 23.91 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.611 0.72 . . . . 74.430000000000007 110.878 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.594 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 54.0 Cg_endo -69.77 -8.97 24.97 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.691 2.26 . . . . 72.219999999999999 112.387 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -102.67 -17.61 15.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 74.329999999999998 111.116 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.9 ttmm -73.44 -51.9 15.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 73.109999999999999 110.918 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.557 ' O ' HG12 ' A' ' 69' ' ' VAL . 81.5 m-85 -95.43 23.03 6.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 75.120000000000005 110.948 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.594 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -86.99 -19.96 27.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.118 -0.492 . . . . 73.219999999999999 111.075 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 8.2 p -88.67 -19.92 25.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 50.340000000000003 110.822 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 1.062 HG21 HD11 ' A' ' 80' ' ' ILE . 7.0 p -51.53 148.28 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 70.409999999999997 111.125 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -105.82 89.44 3.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 75.150000000000006 110.862 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.801 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.5 OUTLIER -51.32 -30.38 18.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 62.509999999999998 111.169 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -61.25 -48.5 81.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.187 -0.46 . . . . 65.010000000000005 110.909 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.85 112.57 2.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.159 -0.473 . . . . 75.109999999999999 110.877 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.42 -24.64 31.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.155 -0.475 . . . . 54.539999999999999 110.887 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -66.9 -54.01 26.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 74.439999999999998 110.885 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 1.1 mm-40 -59.83 -57.89 10.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 73.450000000000003 110.876 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.622 HG21 HG11 ' A' ' 52' ' ' VAL . 2.0 p -51.88 -32.21 14.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 74.519999999999996 111.144 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 9.9 mtm -68.11 -53.22 26.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 65.310000000000002 110.855 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.9 mttm -55.75 -38.14 69.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 60.109999999999999 110.884 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 1.062 HD11 HG21 ' A' ' 69' ' ' VAL . 30.0 mt -66.65 -55.63 17.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 63.229999999999997 111.154 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.773 HG23 ' HB ' ' A' ' 86' ' ' ILE . 93.0 mt -59.98 -36.78 69.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 51.310000000000002 111.137 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -71.22 -52.08 21.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 40.409999999999997 110.854 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -60.21 -51.16 70.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.161 -0.472 . . . . 72.519999999999996 110.876 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -70.03 -11.16 60.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 55.229999999999997 110.86 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 26.9 mmtt 58.12 49.19 11.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 74.099999999999994 110.856 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.773 ' HB ' HG23 ' A' ' 81' ' ' ILE . 14.2 mt -78.28 125.74 84.43 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.607 0.718 . . . . 70.040000000000006 111.13 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 158.3 57.43 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.682 2.255 . . . . 64.010000000000005 112.325 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.549 HG22 ' O ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -87.41 172.23 9.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 62.210000000000001 111.149 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.9 t -52.28 -51.69 30.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 74.010000000000005 111.111 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -51.6 -51.97 51.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 71.219999999999999 110.859 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 43.0 mm-40 -58.13 -40.77 82.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 72.400000000000006 110.956 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 23.6 t90 -64.89 -40.5 95.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 73.329999999999998 110.945 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.69 -52.45 60.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.233 -0.439 . . . . 71.0 110.88 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -59.18 -43.97 92.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 74.129999999999995 110.849 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -59.38 -48.81 80.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.462 . . . . 72.340000000000003 110.873 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.2 p -66.28 -38.75 88.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.23 -0.441 . . . . 54.299999999999997 111.142 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 12.2 mtm180 -60.75 -57.33 13.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 71.140000000000001 110.876 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 46.5 mtp180 -62.66 -39.09 92.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 73.310000000000002 110.852 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -59.44 -43.74 93.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.161 -0.472 . . . . 65.430000000000007 110.938 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 13.6 mmtp -79.82 -25.46 40.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.097 -0.501 . . . . 65.409999999999997 110.91 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -79.88 -177.46 5.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 65.540000000000006 110.921 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.7 t 62.72 38.29 12.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 74.540000000000006 110.848 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 89.6 p -82.63 -169.39 2.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.128 -0.487 . . . . 55.520000000000003 110.856 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.446 HG22 ' N ' ' A' ' 105' ' ' GLN . 10.0 mt -79.59 158.59 4.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.085 -0.507 . . . . 72.239999999999995 111.146 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.446 ' N ' HG22 ' A' ' 104' ' ' ILE . 0.0 OUTLIER -48.96 164.92 0.06 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.175 -0.466 . . . . 75.239999999999995 110.921 179.91 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 23.2 mm -118.7 151.11 20.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 43.009999999999998 111.124 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -100.67 -138.8 10.43 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.77 -0.728 . . . . 54.520000000000003 112.532 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -77.31 128.46 34.34 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.914 0.388 . . . . 65.219999999999999 110.881 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -129.43 -72.11 0.13 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.707 -0.758 . . . . 71.299999999999997 112.462 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 -58.79 99.64 0.05 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.865 0.364 . . . . 74.510000000000005 110.873 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -85.12 -74.69 1.25 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.786 -0.721 . . . . 73.519999999999996 112.46 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -162.74 121.03 2.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.798 0.332 . . . . 60.140000000000001 110.913 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 44.9 m -86.59 171.96 10.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 72.409999999999997 110.857 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -106.78 -26.65 11.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.12 -0.491 . . . . 72.420000000000002 110.916 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 67.58 59.49 6.62 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.766 -0.731 . . . . 64.109999999999999 112.47 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 82.0 mt -118.8 -46.98 2.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.825 0.345 . . . . 60.240000000000002 110.911 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 75.040000000000006 110.902 179.941 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' -9' ' ' GLY . . . . . 0.49 ' N ' HD11 ' B' ' -6' ' ' ILE . . . . . . . . 0 N--CA 1.451 -0.336 0 N-CA-C 112.475 -0.25 . . . . 74.310000000000002 112.475 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.67 -30.41 32.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.769 0.319 . . . . 70.219999999999999 110.9 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' -7' ' ' PHE . . . . . 0.501 ' HB3' HD12 ' A' ' 49' ' ' LEU . 66.9 m-85 -75.21 -75.0 0.18 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.266 -0.425 . . . . 74.450000000000003 110.887 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' -6' ' ' ILE . . . . . 0.49 HD11 ' N ' ' B' ' -9' ' ' GLY . 19.3 mm 51.81 77.08 0.48 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.57 0.7 . . . . 74.510000000000005 111.127 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 92.36 0.51 Allowed 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.654 2.236 . . . . 74.150000000000006 112.368 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 29.1 t -89.44 3.54 51.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 45.009999999999998 110.861 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.47 162.17 0.72 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.623 0.725 . . . . 74.019999999999996 110.861 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -16.16 37.65 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.653 2.236 . . . . 53.229999999999997 112.354 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.3 80.56 0.23 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.617 0.723 . . . . 70.409999999999997 111.113 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 154.1 68.1 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.691 2.261 . . . . 52.100000000000001 112.335 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -93.51 159.54 34.81 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.555 0.693 . . . . 64.209999999999994 110.87 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 166.8 26.41 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.685 2.256 . . . . 75.200000000000003 112.315 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 -27.49 26.56 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.731 2.287 . . . . 60.240000000000002 112.332 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 47.5 t -104.23 97.54 7.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 74.329999999999998 110.894 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 22.4 p -101.77 147.26 26.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 63.310000000000002 110.908 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.459 . . . . 70.519999999999996 111.119 179.9 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 16.7 ptm . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.82 0.343 . . . . 73.150000000000006 110.87 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' -1' ' ' ALA . . . . . 0.592 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -109.96 160.33 28.51 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.59 0.71 . . . . 52.43 111.087 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.592 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 54.0 Cg_endo -69.79 95.43 0.56 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.691 2.261 . . . . 64.049999999999997 112.348 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.583 ' CD1' HD12 ' A' ' 28' ' ' ILE . 1.4 pp -105.44 138.26 41.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.266 -0.424 . . . . 53.039999999999999 110.938 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.608 ' CE1' HD12 ' A' ' 60' ' ' LEU . 19.0 m-85 -118.49 152.05 36.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.2 -0.454 . . . . 70.109999999999999 110.869 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 1.049 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -120.06 163.14 18.1 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 73.150000000000006 111.13 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.416 ' O ' HG13 ' A' ' 5' ' ' VAL . 5.6 p -133.75 119.26 32.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 74.319999999999993 111.132 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.732 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -67.14 139.19 57.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.461 . . . . 73.120000000000005 111.127 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.0 mt -106.02 -18.37 14.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.265 -0.425 . . . . 61.009999999999998 110.941 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -139.06 163.9 31.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.168 -0.469 . . . . 71.120000000000005 110.945 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -80.44 113.45 18.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.114 -0.494 . . . . 73.109999999999999 110.908 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -98.17 111.57 23.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.217 -0.447 . . . . 74.319999999999993 110.853 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.05 121.01 26.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.491 . . . . 73.420000000000002 110.906 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.446 ' HB1' ' HB3' ' A' ' 17' ' ' GLU . . . -74.93 156.53 36.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 54.119999999999997 111.126 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -124.18 -37.69 2.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.257 -0.429 . . . . 63.140000000000001 110.891 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.7 mmt180 -128.85 178.92 6.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.179 -0.464 . . . . 71.340000000000003 110.87 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -55.84 -44.54 78.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.2 -0.455 . . . . 74.140000000000001 110.872 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -54.54 -51.91 63.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 75.510000000000005 110.883 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.446 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 0.1 OUTLIER -60.55 147.94 39.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 74.049999999999997 110.858 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.3 tp -128.82 120.81 26.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.168 -0.469 . . . . 72.099999999999994 110.951 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -66.47 137.46 56.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.461 . . . . 75.230000000000004 110.859 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.732 ' CG1' HG21 ' A' ' 6' ' ' THR . 7.2 p -153.15 146.07 14.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 72.430000000000007 111.09 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.6 m -103.42 160.47 26.04 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 121.735 0.779 . . . . 71.420000000000002 110.825 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 118.36 5.64 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.685 2.257 . . . . 73.25 112.334 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.02 5.02 31.08 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.717 -0.754 . . . . 72.329999999999998 112.499 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -92.18 156.87 17.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.893 0.378 . . . . 73.420000000000002 110.899 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.498 ' CB ' HD12 ' A' ' 42' ' ' ILE . 4.7 m120 -104.45 133.76 48.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.152 -0.476 . . . . 72.010000000000005 110.864 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.544 HD11 HG21 ' A' ' 20' ' ' VAL . 4.4 mp -133.82 149.47 51.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.475 . . . . 73.329999999999998 110.929 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.8 t -100.86 112.59 25.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 53.229999999999997 110.869 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 1.049 HD11 ' HB2' ' A' ' 4' ' ' ALA . 57.5 mt -77.02 150.83 5.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.133 -0.485 . . . . 73.109999999999999 111.15 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 34.0 m -125.85 -36.69 2.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 74.0 110.858 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.0 179.2 9.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.456 . . . . 55.329999999999998 111.069 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.712 ' O ' HG23 ' A' ' 89' ' ' VAL . 1.5 p80 -132.82 178.21 7.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 71.25 110.806 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -137.8 99.09 3.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.167 -0.47 . . . . 72.439999999999998 110.947 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.9 t70 53.07 26.54 4.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.469 . . . . 71.409999999999997 110.862 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.592 ' HD2' HD12 ' A' ' 81' ' ' ILE . 23.4 m-85 62.85 26.06 15.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 64.420000000000002 110.903 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.433 ' O ' HG23 ' A' ' 52' ' ' VAL . 12.2 mm-40 -114.48 -40.27 3.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.13 -0.487 . . . . 74.25 110.894 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -122.3 155.48 35.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.12 -0.491 . . . . 73.409999999999997 110.95 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.759 ' CD2' HG22 ' A' ' 52' ' ' VAL . 2.4 m-85 -128.19 130.83 48.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 64.450000000000003 110.855 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 48' ' ' GLY . 19.0 mm -91.33 94.12 4.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 64.340000000000003 111.128 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -116.23 157.07 25.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 70.329999999999998 111.116 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.3 pttp -123.25 156.84 62.8 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.564 0.697 . . . . 74.310000000000002 110.9 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 127.85 15.2 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.664 2.243 . . . . 74.409999999999997 112.401 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.498 HD12 ' CB ' ' A' ' 25' ' ' ASN . 60.1 mt -84.87 -44.02 17.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 72.510000000000005 111.11 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' A ASN . . . . . . . . . . . . . 25.4 m120 -91.21 -47.58 7.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.151 -0.477 . . . . 72.329999999999998 110.883 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' B ARG . . . . . . . . . . . . . 14.2 mtp180 -66.3 -170.77 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.436 . . . . 70.329999999999998 110.902 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.9 mt -129.32 122.72 30.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 71.25 110.932 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 179.95 -80.1 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.737 -0.744 . . . . 74.319999999999993 112.467 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 139.96 -165.28 25.97 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.705 -0.76 . . . . 73.540000000000006 112.496 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 134.7 28.58 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.645 2.23 . . . . 54.32 112.373 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.663 ' O ' HG23 ' A' ' 38' ' ' ILE . . . -136.83 -120.51 1.95 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.713 -0.756 . . . . 54.409999999999997 112.443 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -159.45 125.9 4.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.832 0.348 . . . . 73.340000000000003 110.891 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.694 HG21 HG21 ' A' ' 55' ' ' VAL . 3.0 m -136.47 138.88 27.94 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.606 0.717 . . . . 65.530000000000001 111.134 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 130.01 18.57 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.664 2.243 . . . . 70.120000000000005 112.369 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.759 HG22 ' CD2' ' A' ' 37' ' ' PHE . 22.1 t -57.35 -21.69 15.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 71.239999999999995 111.132 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.4 p -74.34 -6.26 47.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 53.329999999999998 110.888 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -119.52 -25.27 6.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.101 -0.5 . . . . 72.519999999999996 110.893 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.868 HG13 ' HB1' ' A' ' 4' ' ' ALA . 1.3 t -106.16 138.69 30.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 73.299999999999997 111.105 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.8 ttp180 -111.2 123.64 50.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 64.219999999999999 110.855 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.739 HD11 ' CE2' ' A' ' 37' ' ' PHE . 24.2 mm -70.79 128.88 34.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 74.450000000000003 111.141 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 16.0 pt -145.69 174.12 3.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 61.109999999999999 111.129 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -117.84 130.19 56.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.186 -0.461 . . . . 74.439999999999998 110.872 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.608 HD12 ' CE1' ' A' ' 3' ' ' PHE . 3.8 mt -58.04 -22.73 51.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 71.239999999999995 110.895 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.4 mmt -89.54 -27.93 19.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 73.530000000000001 110.899 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -152.58 75.84 6.95 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.659 0.743 . . . . 73.5 110.857 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.738 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.9 Cg_endo -69.78 -8.52 23.82 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.676 2.251 . . . . 63.119999999999997 112.313 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.34 -15.33 24.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 71.530000000000001 111.128 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -76.16 -52.04 10.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 72.25 110.878 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.611 ' O ' HG12 ' A' ' 69' ' ' VAL . 57.6 m-85 -96.21 23.46 6.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 75.299999999999997 110.894 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.738 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -87.58 -18.02 30.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 52.43 111.08 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.0 p -89.96 -23.79 21.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 71.200000000000003 110.853 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.611 HG12 ' O ' ' A' ' 66' ' ' TYR . 8.2 p -53.32 139.17 11.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.129 -0.487 . . . . 74.530000000000001 111.097 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -94.32 91.38 6.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 74.420000000000002 110.893 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.747 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -51.3 -30.23 17.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.178 -0.465 . . . . 74.319999999999993 111.127 -179.866 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -58.95 -48.1 82.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 71.140000000000001 110.927 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -64.03 111.08 2.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.138 -0.483 . . . . 62.340000000000003 110.851 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.59 -24.76 34.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 74.430000000000007 110.874 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -66.79 -55.25 15.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.461 . . . . 65.239999999999995 110.907 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.52 ' O ' HD12 ' A' ' 80' ' ' ILE . 0.6 OUTLIER -58.77 -58.32 9.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.129 -0.487 . . . . 70.430000000000007 110.909 -179.948 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 1.8 p -51.45 -31.46 12.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 75.400000000000006 111.091 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.7 mtm -68.49 -51.58 41.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 73.230000000000004 110.879 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 32.8 mttt -56.36 -43.77 79.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.466 . . . . 75.120000000000005 110.9 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.52 HD12 ' O ' ' A' ' 76' ' ' GLN . 1.7 mp -63.62 -56.05 19.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 65.349999999999994 111.116 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.646 HG23 ' HB ' ' A' ' 86' ' ' ILE . 85.2 mt -55.88 -37.16 46.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.465 . . . . 75.439999999999998 111.145 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -71.23 -51.99 21.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 72.540000000000006 110.829 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -58.5 -51.21 70.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 61.409999999999997 110.906 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -67.8 -14.77 63.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 64.099999999999994 110.883 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.5 mmtt 61.09 52.83 3.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.095 -0.502 . . . . 75.219999999999999 110.931 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.646 ' HB ' HG23 ' A' ' 81' ' ' ILE . 37.3 mt -81.5 131.9 56.92 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.637 0.732 . . . . 74.430000000000007 111.103 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 153.45 68.74 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.659 2.24 . . . . 73.140000000000001 112.331 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.63 165.96 13.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 73.239999999999995 111.139 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.712 HG23 ' O ' ' A' ' 31' ' ' HIS . 86.1 t -51.24 -58.09 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 65.439999999999998 111.149 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -50.81 -51.2 53.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.176 -0.465 . . . . 73.019999999999996 110.892 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 55.5 mm-40 -57.12 -41.6 79.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.479 . . . . 74.109999999999999 110.918 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 29.3 t90 -65.37 -36.96 85.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.201 -0.454 . . . . 74.530000000000001 110.936 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.3 mmpp? -65.75 -50.08 66.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 74.310000000000002 110.875 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.62 -44.86 96.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 75.109999999999999 110.844 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 40.5 mm-40 -60.22 -47.56 85.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 73.319999999999993 110.914 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 26.4 p -65.98 -47.42 74.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.192 -0.458 . . . . 74.310000000000002 111.122 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 18.9 mmm180 -53.58 -50.89 64.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 71.450000000000003 110.856 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 23.8 mtt-85 -69.71 -32.73 71.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.466 . . . . 74.129999999999995 110.854 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 28.9 t80 -65.05 -37.62 88.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 74.439999999999998 110.889 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 38.5 mttt -84.96 -25.67 27.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 63.43 110.867 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -79.34 -177.97 5.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.245 -0.434 . . . . 61.140000000000001 110.892 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.5 m -107.72 107.96 18.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.156 -0.475 . . . . 71.140000000000001 110.843 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 1.7 m -159.93 -178.37 6.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.171 -0.468 . . . . 72.510000000000005 110.872 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 6.6 mm -104.36 161.28 4.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 63.210000000000001 111.105 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.549 ' O ' HD13 ' A' ' 106' ' ' ILE . 3.2 mt-30 -71.46 -169.32 0.4 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 72.099999999999994 110.891 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.549 HD13 ' O ' ' A' ' 105' ' ' GLN . 28.1 mm -139.91 94.49 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 73.530000000000001 111.118 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -129.83 118.02 2.48 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.719 -0.753 . . . . 71.310000000000002 112.47 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -119.43 129.71 54.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.862 0.363 . . . . 75.540000000000006 110.833 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -141.63 116.87 1.13 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.758 -0.734 . . . . 41.109999999999999 112.502 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -136.97 56.67 1.79 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.896 0.379 . . . . 55.340000000000003 110.844 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -138.79 -156.97 7.19 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.775 -0.726 . . . . 72.310000000000002 112.524 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -148.88 109.78 4.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.794 0.33 . . . . 75.329999999999998 110.895 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.22 137.19 57.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 41.350000000000001 110.862 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 38.8 mm-40 -76.79 164.54 25.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.148 -0.478 . . . . 72.439999999999998 110.901 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -139.72 57.88 0.6 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.739 -0.743 . . . . 74.430000000000007 112.492 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -115.83 169.0 9.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.758 0.313 . . . . 70.230000000000004 110.957 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 74.120000000000005 110.908 179.889 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' -9' ' ' GLY . . . . . 0.673 ' N ' HD11 ' B' ' -6' ' ' ILE . . . . . . . . 0 N--CA 1.451 -0.358 0 N-CA-C 112.476 -0.25 . . . . 64.299999999999997 112.476 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -78.81 -66.25 0.89 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.811 0.338 . . . . 74.329999999999998 110.87 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -68.63 -71.33 0.22 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 74.329999999999998 110.94 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' -6' ' ' ILE . . . . . 0.673 HD11 ' N ' ' B' ' -9' ' ' GLY . 24.3 mm 51.07 74.29 0.83 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.633 0.73 . . . . 73.400000000000006 111.115 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 127.98 15.35 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.655 2.237 . . . . 65.340000000000003 112.322 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.89 12.11 9.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 62.329999999999998 110.86 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.69 162.43 0.74 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.595 0.712 . . . . 74.099999999999994 110.866 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -11.34 30.66 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.69 2.26 . . . . 71.349999999999994 112.369 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 57.79 80.93 0.26 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.59 0.709 . . . . 72.400000000000006 111.08 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 144.04 52.64 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.703 2.269 . . . . 73.019999999999996 112.326 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 38.8 mtmt -80.29 160.87 66.94 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.544 0.687 . . . . 73.409999999999997 110.906 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 165.68 30.1 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.666 2.244 . . . . 63.100000000000001 112.344 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 96.75 0.61 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.708 2.272 . . . . 52.219999999999999 112.309 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 1.5 m -115.06 -52.53 2.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 70.230000000000004 110.837 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -136.3 116.05 13.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 70.340000000000003 110.845 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 43.210000000000001 111.092 179.909 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.781 0.325 . . . . 73.400000000000006 110.91 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' -1' ' ' ALA . . . . . 0.575 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -51.48 160.66 0.95 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.637 0.732 . . . . 63.310000000000002 111.077 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.575 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 54.0 Cg_endo -69.73 124.61 11.27 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.686 2.257 . . . . 61.039999999999999 112.352 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.681 HD21 HD11 ' A' ' 86' ' ' ILE . 0.0 OUTLIER -108.97 119.47 39.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 65.209999999999994 110.919 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.75 ' CZ ' HD12 ' A' ' 60' ' ' LEU . 81.0 m-85 -137.92 139.89 40.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 75.129999999999995 110.879 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.445 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -130.34 157.99 41.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.135 -0.484 . . . . 62.409999999999997 111.133 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 24' ' ' GLU . 8.5 p -124.13 128.5 74.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 71.0 111.149 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.682 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.2 OUTLIER -72.48 127.43 32.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 52.32 111.133 -179.934 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.3 mt -101.21 -18.66 16.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.204 -0.453 . . . . 63.020000000000003 110.913 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -133.78 161.56 34.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 62.450000000000003 110.898 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -82.02 105.49 13.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 65.519999999999996 110.876 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -87.28 125.46 34.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 61.43 110.879 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.43 104.39 14.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 71.040000000000006 110.874 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.678 ' HB1' ' HB2' ' A' ' 17' ' ' GLU . . . -53.53 160.37 1.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 64.239999999999995 111.094 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -118.47 -32.22 4.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 74.5 110.879 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -124.09 -175.79 3.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 62.210000000000001 110.821 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -67.07 -38.93 86.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.459 . . . . 64.120000000000005 110.852 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -59.65 -53.1 61.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.231 -0.44 . . . . 75.239999999999995 110.844 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.678 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 5.2 mm-40 -54.24 164.65 0.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.218 -0.446 . . . . 74.329999999999998 110.862 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.408 HD22 ' HD3' ' A' ' 41' ' ' PRO . 4.5 tp -139.46 142.8 37.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.489 . . . . 73.439999999999998 110.868 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -86.6 143.09 27.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.466 . . . . 71.230000000000004 110.848 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.682 ' CG1' HG21 ' A' ' 6' ' ' THR . 6.7 p -153.11 144.03 14.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.226 -0.443 . . . . 74.25 111.109 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.4 m -102.32 160.33 26.67 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.637 0.732 . . . . 42.020000000000003 110.873 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 126.38 13.26 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.652 2.235 . . . . 74.510000000000005 112.332 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.0 -0.21 31.64 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.737 -0.744 . . . . 74.530000000000001 112.508 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.409 ' O ' HG23 ' A' ' 5' ' ' VAL . 2.8 mm-40 -92.11 170.37 9.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.86 0.362 . . . . 74.5 110.86 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -116.26 130.06 56.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 74.299999999999997 110.852 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.763 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 3.1 mp -125.09 144.79 50.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.17 -0.468 . . . . 62.210000000000001 110.927 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -97.31 112.66 24.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 53.140000000000001 110.842 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.611 ' HB ' HD12 ' A' ' 2' ' ' LEU . 58.8 mt -78.86 141.52 15.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 74.230000000000004 111.108 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 55.3 m -119.33 -48.81 2.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 73.239999999999995 110.861 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.422 ' HA ' HG22 ' A' ' 86' ' ' ILE . . . -146.09 172.68 13.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 74.540000000000006 111.084 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.513 ' O ' HG23 ' A' ' 89' ' ' VAL . 1.3 p80 -128.06 178.25 6.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.242 -0.435 . . . . 70.319999999999993 110.829 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -138.77 99.88 3.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 75.150000000000006 110.933 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.1 t70 54.26 26.35 6.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.135 -0.484 . . . . 60.210000000000001 110.839 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.593 ' HD2' HD12 ' A' ' 81' ' ' ILE . 38.4 m-85 63.08 25.37 14.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.204 -0.453 . . . . 73.219999999999999 110.933 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.488 ' O ' HG23 ' A' ' 52' ' ' VAL . 14.7 mm-40 -114.11 -50.01 2.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 74.439999999999998 110.858 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.531 ' HB3' HD21 ' A' ' 49' ' ' LEU . 67.9 m95 -111.42 143.97 41.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.167 -0.47 . . . . 73.109999999999999 110.9 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.679 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -119.69 133.5 55.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.442 . . . . 74.329999999999998 110.918 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.8 mm -88.79 95.23 5.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 72.310000000000002 111.145 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.763 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.6 142.7 42.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.205 -0.452 . . . . 75.329999999999998 111.105 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.52 153.63 46.65 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.558 0.694 . . . . 72.010000000000005 110.889 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.408 ' HD3' HD22 ' A' ' 18' ' ' LEU . 53.6 Cg_endo -69.79 105.89 1.57 Allowed 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.683 2.255 . . . . 64.049999999999997 112.369 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.7 mt -68.52 -36.7 75.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.242 -0.435 . . . . 73.430000000000007 111.107 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' A ASN . . . . . . . . . . . . . 40.9 m-80 -98.05 -59.93 1.66 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.203 -0.453 . . . . 53.439999999999998 110.845 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' B ARG . . . . . . . . . . . . . 5.6 mmp_? -53.57 165.76 0.37 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 72.349999999999994 110.87 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 44' ' ' LEU . 12.4 mt -128.9 120.97 27.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.457 . . . . 62.119999999999997 110.91 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 179.05 -41.53 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.729 -0.748 . . . . 52.130000000000003 112.48 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 137.61 165.78 10.5 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.687 -0.768 . . . . 71.409999999999997 112.511 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.76 144.99 55.77 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.665 2.244 . . . . 74.310000000000002 112.325 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -127.7 -137.1 4.39 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.754 -0.736 . . . . 53.340000000000003 112.468 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.531 HD21 ' HB3' ' A' ' 36' ' ' TRP . 1.2 tt -149.55 125.84 10.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.861 0.362 . . . . 54.43 110.908 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 12.4 p -136.58 132.7 18.77 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.622 0.725 . . . . 62.229999999999997 111.096 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.593 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.6 Cg_endo -69.78 151.53 68.97 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.707 2.272 . . . . 64.430000000000007 112.287 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.771 HG12 ' HB ' ' A' ' 71' ' ' THR . 14.2 t -62.9 -21.9 29.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.232 -0.44 . . . . 72.409999999999997 111.155 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.1 m -78.4 -2.4 38.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 61.340000000000003 110.877 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -125.07 17.58 8.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 74.219999999999999 110.907 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.593 HG22 ' O ' ' A' ' 51' ' ' PRO . 5.2 m -153.56 153.1 9.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 73.140000000000001 111.127 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.53 ' HG2' HG23 ' A' ' 58' ' ' ILE . 18.5 ttm180 -123.75 119.84 30.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.151 -0.477 . . . . 71.209999999999994 110.915 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 16.1 mm -67.19 113.81 3.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 75.549999999999997 111.168 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.53 HG23 ' HG2' ' A' ' 56' ' ' ARG . 1.2 pt -135.33 139.07 47.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 61.329999999999998 111.126 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -75.27 122.07 23.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 71.019999999999996 110.878 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.75 HD12 ' CZ ' ' A' ' 3' ' ' PHE . 0.6 OUTLIER -51.98 -31.7 30.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.213 -0.449 . . . . 73.439999999999998 110.876 -179.912 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -85.56 -28.52 24.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 74.040000000000006 110.869 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -143.96 77.53 14.61 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.638 0.732 . . . . 63.240000000000002 110.896 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.737 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.6 Cg_endo -69.78 -8.17 22.92 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.675 2.25 . . . . 75.120000000000005 112.367 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.91 -5.69 44.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 70.129999999999995 111.125 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -84.04 -51.75 6.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 72.099999999999994 110.904 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.615 ' O ' HG12 ' A' ' 69' ' ' VAL . 12.2 m-85 -99.87 23.62 9.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 74.209999999999994 110.931 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.737 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -83.37 -15.93 47.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.122 -0.49 . . . . 62.32 111.112 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 8.9 m -98.14 -18.74 18.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.439999999999998 110.894 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 1.026 HG21 HD11 ' A' ' 80' ' ' ILE . 9.3 p -51.14 150.22 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.092 -0.504 . . . . 74.099999999999994 111.129 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -104.76 88.5 2.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 74.120000000000005 110.84 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.771 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -51.89 -43.22 63.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.219 -0.446 . . . . 63.329999999999998 111.089 -179.857 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -53.67 -43.89 69.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.282 -0.417 . . . . 74.099999999999994 110.92 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -63.92 110.15 2.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 71.109999999999999 110.864 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.23 -26.33 28.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 72.010000000000005 110.857 -179.862 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -67.11 -56.07 11.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 71.010000000000005 110.893 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -59.2 -56.65 19.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.479 . . . . 73.340000000000003 110.902 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.414 HG21 HG11 ' A' ' 52' ' ' VAL . 2.8 p -52.48 -32.38 16.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.199 -0.455 . . . . 61.439999999999998 111.168 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 14.2 mtm -67.73 -55.0 14.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 64.209999999999994 110.879 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.5 mttt -54.34 -38.51 66.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 64.209999999999994 110.928 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 1.026 HD11 HG21 ' A' ' 69' ' ' VAL . 88.6 mt -66.05 -54.64 24.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.225 -0.443 . . . . 61.329999999999998 111.149 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.75 HG23 ' HB ' ' A' ' 86' ' ' ILE . 95.1 mt -60.37 -33.88 55.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 64.409999999999997 111.163 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -71.07 -51.84 22.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.176 -0.466 . . . . 54.329999999999998 110.83 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -60.49 -43.09 97.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 72.209999999999994 110.915 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -76.13 -17.78 59.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 74.420000000000002 110.847 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 33.5 mmtm 61.36 52.53 3.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.178 -0.464 . . . . 50.310000000000002 110.891 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.75 ' HB ' HG23 ' A' ' 81' ' ' ILE . 21.2 mt -78.4 131.09 69.59 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.639 0.733 . . . . 72.340000000000003 111.116 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.407 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 53.9 Cg_endo -69.74 158.87 55.5 Favored 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.753 2.302 . . . . 74.420000000000002 112.297 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.41 163.25 16.86 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.183 -0.462 . . . . 63.409999999999997 111.147 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 31' ' ' HIS . 96.2 t -51.01 -58.02 2.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 70.310000000000002 111.169 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -50.85 -46.8 60.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 62.43 110.873 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -59.4 -42.2 91.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 55.210000000000001 110.915 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 12.2 t90 -64.96 -41.55 95.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 62.350000000000001 110.912 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.3 mmtp -62.6 -44.67 95.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.248 -0.433 . . . . 45.109999999999999 110.903 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -64.3 -46.67 82.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.258 -0.428 . . . . 73.200000000000003 110.873 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -57.73 -53.72 55.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 72.530000000000001 110.927 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 4.6 p -61.04 -46.68 89.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.204 -0.453 . . . . 74.129999999999995 111.081 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 19.7 mmm-85 -51.97 -53.88 36.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.25 -0.432 . . . . 75.430000000000007 110.867 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 34.0 mtp180 -65.98 -32.85 74.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 74.140000000000001 110.888 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -64.98 -41.05 95.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 72.299999999999997 110.916 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 35.5 mttp -74.61 -25.17 59.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.133 -0.485 . . . . 74.420000000000002 110.914 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -93.38 -175.14 3.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 74.140000000000001 110.898 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 44.4 m -70.19 120.93 16.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 73.25 110.812 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 13.8 m -72.31 175.03 6.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.108 -0.496 . . . . 72.420000000000002 110.89 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.3 mt -70.41 139.03 20.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.135 -0.484 . . . . 54.43 111.159 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 179.0 167.71 0.94 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 73.409999999999997 110.887 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.486 ' H ' HD13 ' A' ' 106' ' ' ILE . 0.1 OUTLIER -142.24 173.96 6.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 70.200000000000003 111.141 -179.995 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 159.49 116.25 0.43 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.778 -0.725 . . . . 63.020000000000003 112.499 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -68.56 132.29 46.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.859 0.362 . . . . 72.200000000000003 110.89 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 176.96 -95.19 0.1 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.77 -0.729 . . . . 65.109999999999999 112.487 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -91.38 102.92 15.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.843 0.354 . . . . 70.510000000000005 110.825 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 86.16 150.5 15.73 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.75 -0.738 . . . . 72.120000000000005 112.527 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.4 mp0 -86.5 104.03 15.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.812 0.339 . . . . 75.519999999999996 110.911 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.4 m -88.01 -177.56 5.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.197 -0.456 . . . . 51.219999999999999 110.849 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -109.57 138.26 46.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.118 -0.492 . . . . 75.129999999999995 110.917 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -148.16 117.52 0.9 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.77 -0.728 . . . . 61.340000000000003 112.484 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -151.75 170.34 19.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.792 0.33 . . . . 75.319999999999993 110.915 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 74.310000000000002 110.898 179.934 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' -9' ' ' GLY . . . . . 0.552 ' HA3' HD11 ' B' ' -6' ' ' ILE . . . . . . . . 0 N--CA 1.451 -0.306 0 N-CA-C 112.487 -0.245 . . . . 72.530000000000001 112.487 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 25.8 mtmm -122.48 -47.83 2.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.809 0.337 . . . . 72.340000000000003 110.892 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' -7' ' ' PHE . . . . . 0.467 ' HD2' HD12 ' A' ' 49' ' ' LEU . 9.3 m-85 -80.21 -72.0 0.43 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 74.049999999999997 110.865 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' -6' ' ' ILE . . . . . 0.552 HD11 ' HA3' ' B' ' -9' ' ' GLY . 22.2 mm 51.94 77.6 0.45 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.596 0.713 . . . . 64.349999999999994 111.106 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 92.64 0.51 Allowed 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.712 2.275 . . . . 70.510000000000005 112.324 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.09 28.53 3.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.269 -0.423 . . . . 64.209999999999994 110.884 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' -3' ' ' ARG . . . . . 0.486 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 0.5 OUTLIER -89.64 159.09 44.43 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.58 0.705 . . . . 71.340000000000003 110.883 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' -2' ' ' PRO . . . . . 0.486 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 54.1 Cg_endo -69.78 112.41 3.08 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.669 2.246 . . . . 74.340000000000003 112.356 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' -1' ' ' ALA . . . . . 0.429 ' HA ' ' HD2' ' B' ' 0' ' ' PRO . . . -51.22 108.99 1.18 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.641 0.734 . . . . 64.439999999999998 111.087 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 0' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' B' ' -1' ' ' ALA . 53.9 Cg_endo -69.8 147.14 61.98 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.647 2.231 . . . . 61.420000000000002 112.373 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 60.5 mttt -97.6 160.77 27.88 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.592 0.711 . . . . 73.409999999999997 110.868 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 167.85 23.28 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.654 2.236 . . . . 71.450000000000003 112.372 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 112.57 3.11 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.666 2.244 . . . . 75.030000000000001 112.372 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 85.7 p -145.31 173.19 12.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 75.530000000000001 110.897 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 5.9 p -119.21 103.88 9.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.485 . . . . 62.43 110.856 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.135 -0.484 . . . . 62.409999999999997 111.084 179.902 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.751 0.31 . . . . 75.349999999999994 110.925 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' -1' ' ' ALA . . . . . 0.589 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -120.4 160.34 44.19 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.585 0.707 . . . . 64.409999999999997 111.113 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.589 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.9 Cg_endo -69.73 122.4 9.09 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.702 2.268 . . . . 71.310000000000002 112.314 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.675 HD12 HD12 ' A' ' 28' ' ' ILE . 0.8 OUTLIER -120.14 147.19 45.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.248 -0.433 . . . . 75.409999999999997 110.962 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -124.48 143.14 50.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 73.430000000000007 110.849 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.913 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -120.88 151.98 39.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 73.409999999999997 111.088 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.495 HG13 ' HB3' ' A' ' 56' ' ' ARG . 6.2 p -120.17 122.19 67.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.196 -0.457 . . . . 64.140000000000001 111.112 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.718 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -60.24 144.53 50.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 52.049999999999997 111.118 -179.942 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.656 HD11 ' HB2' ' A' ' 56' ' ' ARG . 23.3 mt -117.48 -12.17 10.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 64.420000000000002 110.873 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -134.67 164.75 26.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.238 -0.437 . . . . 65.019999999999996 110.94 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -89.97 105.27 17.7 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.133 -0.485 . . . . 75.310000000000002 110.859 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -87.3 123.47 32.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.149 -0.478 . . . . 71.400000000000006 110.861 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.84 96.88 7.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.176 -0.466 . . . . 74.409999999999997 110.905 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.13 157.69 1.75 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.245 -0.434 . . . . 62.25 111.118 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -116.26 -30.6 5.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.21 -0.45 . . . . 72.239999999999995 110.876 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.5 mmm180 -136.2 -177.11 4.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 74.319999999999993 110.869 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -60.39 -41.2 93.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.156 -0.475 . . . . 64.439999999999998 110.873 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -56.93 -39.85 75.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.145 -0.479 . . . . 73.040000000000006 110.864 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -79.87 143.03 34.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.206 -0.452 . . . . 64.310000000000002 110.913 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.8 tp -119.89 127.8 53.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.145 -0.479 . . . . 53.009999999999998 110.869 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -72.94 139.77 46.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.209 -0.451 . . . . 65.439999999999998 110.852 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.718 ' CG1' HG21 ' A' ' 6' ' ' THR . 11.2 p -147.14 151.75 13.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.465 . . . . 72.209999999999994 111.134 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.5 m -110.23 159.91 30.27 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.657 0.741 . . . . 73.140000000000001 110.853 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 120.15 6.98 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.644 2.229 . . . . 71.219999999999999 112.357 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.08 3.64 31.46 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.76 -0.733 . . . . 53.130000000000003 112.496 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -91.97 149.47 21.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.881 0.372 . . . . 64.230000000000004 110.88 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.604 ' CB ' HD12 ' A' ' 42' ' ' ILE . 6.8 m120 -93.79 139.86 30.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 75.409999999999997 110.926 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.724 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 4.4 mp -141.23 145.4 35.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 73.420000000000002 110.903 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.1 113.9 26.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.444 . . . . 62.420000000000002 110.877 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.913 HD11 ' HB2' ' A' ' 4' ' ' ALA . 43.5 mt -77.22 149.76 6.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.153 -0.476 . . . . 73.140000000000001 111.138 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 21.3 m -123.55 -35.91 2.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 71.329999999999998 110.863 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -166.52 173.62 9.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.182 -0.463 . . . . 63.219999999999999 111.085 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.479 ' ND1' HD13 ' A' ' 81' ' ' ILE . 1.6 p80 -124.11 176.28 6.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 71.230000000000004 110.848 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -137.76 99.56 3.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 75.420000000000002 110.887 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.3 t70 55.07 24.92 6.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.105 -0.498 . . . . 74.5 110.895 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.581 ' HD2' HD12 ' A' ' 81' ' ' ILE . 35.0 m-85 64.08 15.69 9.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 63.539999999999999 110.95 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.505 ' O ' HG23 ' A' ' 52' ' ' VAL . 28.1 mm-40 -103.34 -50.65 3.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.125 -0.489 . . . . 72.549999999999997 110.858 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 83.0 m95 -111.5 162.86 14.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.146 -0.479 . . . . 75.239999999999995 110.964 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.635 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.4 OUTLIER -135.93 146.24 47.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.263 -0.426 . . . . 73.510000000000005 110.896 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 11.6 mm -104.12 95.23 3.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.142 -0.481 . . . . 64.219999999999999 111.122 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.724 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -116.42 145.07 43.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.15 -0.477 . . . . 60.409999999999997 111.075 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.0 ptpp? -116.14 157.46 45.12 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.59 0.709 . . . . 74.340000000000003 110.872 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 131.5 21.46 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.713 2.276 . . . . 35.530000000000001 112.339 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.604 HD12 ' CB ' ' A' ' 25' ' ' ASN . 40.5 mt -91.04 -44.17 14.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.213 -0.449 . . . . 73.299999999999997 111.116 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' A ASN . . . . . . . . . . . . . 32.8 t30 -53.35 -73.84 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.126 -0.488 . . . . 63.329999999999998 110.914 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' B ARG . . . . . . . . . . . . . 9.3 ptm180 -93.24 -179.83 5.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.13 -0.486 . . . . 62.350000000000001 110.849 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.0 mp -84.9 -74.75 0.38 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.14 -0.482 . . . . 72.129999999999995 110.876 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 52.78 -108.18 0.67 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.722 -0.751 . . . . 71.120000000000005 112.469 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -179.97 165.22 33.53 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.702 -0.761 . . . . 64.549999999999997 112.458 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 131.73 21.86 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.685 2.257 . . . . 35.340000000000003 112.323 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -119.57 -153.52 9.3 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.766 -0.73 . . . . 40.009999999999998 112.52 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -130.32 129.33 43.06 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.856 0.36 . . . . 75.230000000000004 110.91 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.5 p -141.15 132.04 13.42 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.668 0.746 . . . . 71.150000000000006 111.098 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.74 165.51 30.69 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.662 2.241 . . . . 72.420000000000002 112.363 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.729 HG12 ' HB ' ' A' ' 71' ' ' THR . 15.3 t -74.1 -21.24 17.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.24 -0.437 . . . . 61.420000000000002 111.154 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 56.4 m -81.3 1.8 30.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.17 -0.468 . . . . 75.439999999999998 110.832 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.559 ' O ' HG22 ' A' ' 6' ' ' THR . 13.9 m-85 -129.26 22.75 5.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 75.540000000000006 110.911 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 27.5 m -151.3 146.41 16.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 75.109999999999999 111.096 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.656 ' HB2' HD11 ' A' ' 7' ' ' LEU . 33.3 ttp85 -115.64 111.66 20.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 65.540000000000006 110.912 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.4 mm -66.05 118.55 9.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.207 -0.451 . . . . 65.140000000000001 111.074 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.459 HG23 ' HG2' ' A' ' 56' ' ' ARG . 15.3 pt -136.1 165.89 28.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 62.409999999999997 111.147 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -109.21 127.31 54.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 70.319999999999993 110.867 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.9 mt -55.48 -29.59 59.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 71.319999999999993 110.889 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.58 -20.19 28.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 74.030000000000001 110.935 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -161.45 82.1 1.93 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.648 0.737 . . . . 75.439999999999998 110.819 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.737 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.7 Cg_endo -69.75 -8.52 23.81 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.717 2.278 . . . . 72.340000000000003 112.351 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.79 0.25 56.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 75.099999999999994 111.109 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -84.31 -47.15 11.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 74.420000000000002 110.889 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.55 ' O ' HG12 ' A' ' 69' ' ' VAL . 19.0 m-85 -110.98 23.71 13.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 74.420000000000002 110.914 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.737 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -78.07 -20.82 51.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 72.209999999999994 111.077 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 80.9 p -104.59 -8.42 18.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.428 . . . . 71.230000000000004 110.846 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.949 HG21 HD11 ' A' ' 80' ' ' ILE . 9.8 p -51.37 157.84 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 70.519999999999996 111.123 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -104.09 82.46 1.97 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.138 -0.483 . . . . 71.450000000000003 110.871 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.729 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -54.29 -44.64 72.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.448 . . . . 63.409999999999997 111.093 -179.877 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -55.28 -40.92 71.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.239 -0.437 . . . . 63.109999999999999 110.948 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -63.96 108.42 1.49 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.103 -0.499 . . . . 73.230000000000004 110.852 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ARG . . . . . 0.404 ' HA ' HG12 ' A' ' 77' ' ' VAL . 0.2 OUTLIER -51.97 -29.3 19.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.455 . . . . 61.219999999999999 110.876 -179.908 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -66.98 -56.42 10.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 73.400000000000006 110.869 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -59.23 -54.9 41.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.461 . . . . 70.230000000000004 110.936 -179.944 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.52 ' HA ' HD12 ' A' ' 80' ' ' ILE . 4.8 p -54.27 -32.68 24.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 74.239999999999995 111.121 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.4 mtm -67.37 -56.04 11.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.474 . . . . 73.319999999999993 110.817 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -54.62 -37.51 65.71 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.247 -0.433 . . . . 64.430000000000007 110.911 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.949 HD11 HG21 ' A' ' 69' ' ' VAL . 27.9 mt -66.22 -55.1 20.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 70.310000000000002 111.14 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.72 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.4 mt -60.51 -36.73 71.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.153 -0.476 . . . . 70.430000000000007 111.149 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -70.93 -46.73 61.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.156 -0.475 . . . . 75.329999999999998 110.857 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -64.42 -47.1 80.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 75.319999999999993 110.853 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -72.34 -12.84 61.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 73.209999999999994 110.898 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.56 53.06 6.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.137 -0.483 . . . . 72.140000000000001 110.881 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.72 ' HB ' HG23 ' A' ' 81' ' ' ILE . 59.0 mt -83.73 132.94 47.44 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.64 0.733 . . . . 75.409999999999997 111.105 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.418 ' HD2' HG23 ' A' ' 86' ' ' ILE . 53.5 Cg_endo -69.76 163.83 36.81 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.705 2.27 . . . . 71.140000000000001 112.324 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.28 169.2 9.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.173 -0.467 . . . . 72.019999999999996 111.135 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 91.7 t -51.43 -56.53 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 71.510000000000005 111.131 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -52.43 -52.13 55.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 63.119999999999997 110.857 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 57.7 mm-40 -56.86 -42.68 80.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 55.140000000000001 110.886 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.45 ' O ' HG23 ' A' ' 96' ' ' THR . 33.4 t90 -66.1 -36.93 84.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 75.209999999999994 110.898 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -68.43 -35.03 77.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 74.420000000000002 110.892 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -72.16 -49.46 35.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 63.140000000000001 110.834 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.4 ' HG2' ' HA ' ' A' ' 92' ' ' TRP . 21.0 pt20 -61.56 -39.94 92.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 71.540000000000006 110.905 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.45 HG23 ' O ' ' A' ' 92' ' ' TRP . 38.1 p -70.57 -44.53 67.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 73.239999999999995 111.153 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -59.17 -44.71 92.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 75.400000000000006 110.902 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -74.26 -34.11 63.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 62.520000000000003 110.898 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -69.18 -29.6 67.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 74.019999999999996 110.966 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -90.88 -17.45 26.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.101 -0.499 . . . . 71.319999999999993 110.877 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.01 179.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.431 . . . . 52.149999999999999 110.933 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.4 m -81.58 -176.52 6.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 72.209999999999994 110.857 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 4.1 m 59.74 36.93 22.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 54.219999999999999 110.914 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 20.2 mm -113.36 148.5 16.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.111 -0.495 . . . . 74.329999999999998 111.163 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -169.0 129.62 1.13 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 74.129999999999995 110.877 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.2 mp -132.24 151.64 35.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 34.509999999999998 111.13 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -80.46 56.68 4.7 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.681 -0.771 . . . . 75.329999999999998 112.51 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -120.05 150.01 41.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.856 0.36 . . . . 55.539999999999999 110.934 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -93.5 58.58 2.26 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.745 -0.741 . . . . 41.409999999999997 112.523 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -175.08 140.45 0.52 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.866 0.365 . . . . 70.409999999999997 110.868 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 167.48 142.96 3.62 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.755 -0.736 . . . . 74.019999999999996 112.48 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -168.63 146.26 3.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.784 0.325 . . . . 73.409999999999997 110.942 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 2.8 p -108.86 174.84 5.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 73.540000000000006 110.894 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 32.5 mm-40 -146.85 179.62 7.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 65.140000000000001 110.893 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -175.12 121.96 0.85 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.722 -0.751 . . . . 73.549999999999997 112.479 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 2.3 mp -127.06 -67.86 0.83 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.773 0.32 . . . . 61.329999999999998 110.942 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.474 . . . . 71.099999999999994 110.878 179.95 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 N-CA-C 112.525 -0.23 . . . . 53.229999999999997 112.525 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 4.1 pttp -133.24 -43.29 0.86 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.805 0.336 . . . . 73.540000000000006 110.907 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 -55.43 -74.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 75.109999999999999 110.868 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.0 mm 51.83 81.0 0.27 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.607 0.718 . . . . 64.349999999999994 111.092 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 81.43 0.82 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.671 2.247 . . . . 73.329999999999998 112.309 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 5.4 t -97.21 37.27 1.35 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 72.099999999999994 110.861 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' -3' ' ' ARG . . . . . 0.446 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 5.6 mmm180 -98.16 160.56 27.98 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.596 0.713 . . . . 54.450000000000003 110.879 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' -2' ' ' PRO . . . . . 0.446 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.6 Cg_endo -69.79 99.53 0.76 Allowed 'Trans proline' 0 C--N 1.34 0.13 0 C-N-CA 122.657 2.238 . . . . 74.439999999999998 112.31 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -51.13 108.96 1.17 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.542 0.687 . . . . 62.439999999999998 111.094 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 154.25 67.98 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.704 2.269 . . . . 74.510000000000005 112.334 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 12.7 mtpp -99.56 160.66 26.83 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.539 0.685 . . . . 73.239999999999995 110.87 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 167.82 23.32 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.693 2.262 . . . . 62.119999999999997 112.335 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 -42.76 3.15 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.683 2.255 . . . . 62.32 112.359 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 3.4 m -79.73 59.34 3.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 63.030000000000001 110.866 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 85.5 p -91.3 -56.96 2.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 73.540000000000006 110.877 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 34.340000000000003 111.1 179.897 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.812 0.339 . . . . 63.149999999999999 110.852 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' -1' ' ' ALA . . . . . 0.589 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -74.17 160.51 81.38 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.534 0.683 . . . . 75.239999999999995 111.092 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.589 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.5 Cg_endo -69.8 172.81 11.99 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.69 2.26 . . . . 75.019999999999996 112.327 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.777 HD12 HD13 ' A' ' 86' ' ' ILE . 0.1 OUTLIER -155.02 120.43 5.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 53.130000000000003 110.923 179.944 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.463 ' CE2' HD12 ' A' ' 60' ' ' LEU . 97.1 m-85 -128.55 139.55 52.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.466 . . . . 61.450000000000003 110.866 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.477 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -133.93 159.55 40.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.49 . . . . 34.32 111.111 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.6 p -124.75 127.05 72.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 70.420000000000002 111.11 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.665 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -67.04 126.95 30.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.209 -0.451 . . . . 53.299999999999997 111.106 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.553 HD11 ' HB2' ' A' ' 56' ' ' ARG . 66.1 mt -101.73 -17.68 16.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 50.32 110.906 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -132.87 160.82 35.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 72.299999999999997 110.889 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -86.42 105.08 16.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.084 -0.507 . . . . 72.329999999999998 110.852 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -84.81 126.17 33.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 65.109999999999999 110.894 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.4 mttm -101.91 100.17 10.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.119 -0.491 . . . . 70.319999999999993 110.905 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.74 149.68 5.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 70.299999999999997 111.091 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -123.05 -36.34 2.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 73.019999999999996 110.884 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.9 mmt180 -114.56 -178.19 3.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 75.140000000000001 110.861 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -68.36 -35.68 78.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 71.230000000000004 110.865 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -67.96 -41.17 82.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.242 -0.436 . . . . 61.25 110.858 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.15 166.77 3.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 63.020000000000003 110.904 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.2 tp -142.37 149.96 40.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 44.439999999999998 110.948 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -94.67 131.46 40.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 71.530000000000001 110.867 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.665 ' CG1' HG21 ' A' ' 6' ' ' THR . 14.8 p -148.59 149.49 15.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 72.439999999999998 111.101 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.9 m -110.67 160.43 28.7 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.646 0.736 . . . . 74.439999999999998 110.859 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 128.2 15.67 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.71 2.273 . . . . 72.219999999999999 112.334 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.09 -6.02 32.28 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.709 -0.758 . . . . 54.119999999999997 112.509 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -92.2 155.18 18.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.852 0.358 . . . . 51.530000000000001 110.871 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.69 ' C ' HD22 ' A' ' 26' ' ' LEU . 7.1 m120 -96.14 139.25 32.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.030000000000001 110.917 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.69 HD22 ' C ' ' A' ' 25' ' ' ASN . 3.5 mm? -131.57 142.01 49.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.18 -0.464 . . . . 72.129999999999995 110.886 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.82 116.78 33.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.209 -0.45 . . . . 44.130000000000003 110.842 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.599 ' HB ' HD13 ' A' ' 2' ' ' LEU . 26.4 mt -84.08 146.01 7.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.106 -0.497 . . . . 72.209999999999994 111.115 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 22.9 m -118.53 -27.76 5.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 65.150000000000006 110.828 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.44 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -169.67 178.48 4.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.45 . . . . 65.530000000000001 111.128 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.469 ' ND1' HD13 ' A' ' 81' ' ' ILE . 1.6 p80 -129.47 176.59 7.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.254 -0.43 . . . . 72.319999999999993 110.862 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -137.89 99.4 3.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 74.099999999999994 110.857 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 46.6 t0 54.31 25.69 6.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 72.450000000000003 110.831 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.603 ' HD2' HD12 ' A' ' 81' ' ' ILE . 25.6 m-85 63.26 23.1 13.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.194 -0.457 . . . . 62.140000000000001 110.958 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.49 ' O ' HG23 ' A' ' 52' ' ' VAL . 21.9 mm-40 -111.79 -53.3 2.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.505 . . . . 73.329999999999998 110.899 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 79.9 m95 -109.13 144.26 37.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.152 -0.477 . . . . 74.549999999999997 110.929 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.79 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.4 OUTLIER -117.59 130.09 56.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.435 . . . . 75.150000000000006 110.873 -179.965 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.1 mm -87.9 95.11 4.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.119 -0.491 . . . . 65.109999999999999 111.153 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.683 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.09 157.75 19.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 60.130000000000003 111.066 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -132.33 157.94 76.93 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.558 0.694 . . . . 72.230000000000004 110.872 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 115.15 3.95 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.679 2.253 . . . . 75.230000000000004 112.324 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.8 mt -79.36 -44.59 23.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.469 . . . . 75.409999999999997 111.145 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' A ASN . . . . . . . . . . . . . 5.1 m-20 -52.97 -64.02 0.95 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.214 -0.448 . . . . 70.150000000000006 110.908 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' B ARG . . . . . . . . . . . . . 0.3 OUTLIER -103.97 169.87 8.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.455 . . . . 65.510000000000005 110.831 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 56.2 mt -74.29 -73.03 0.25 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.161 -0.472 . . . . 74.310000000000002 110.911 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 52.64 -111.39 1.6 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.709 -0.758 . . . . 34.32 112.452 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -174.33 165.88 37.59 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.757 -0.735 . . . . 65.010000000000005 112.507 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 139.5 40.43 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.703 2.268 . . . . 71.25 112.353 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -128.17 -144.97 5.96 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.746 -0.74 . . . . 13.130000000000001 112.514 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -147.98 129.87 15.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.869 0.366 . . . . 71.209999999999994 110.867 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.0 p -142.36 132.83 12.59 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.634 0.731 . . . . 72.140000000000001 111.101 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.572 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.6 Cg_endo -69.78 152.27 69.18 Favored 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.656 2.238 . . . . 74.150000000000006 112.355 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.79 HG22 ' CD2' ' A' ' 37' ' ' PHE . 13.7 t -62.52 -22.31 29.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.225 -0.443 . . . . 72.219999999999999 111.146 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.9 t -78.04 -3.18 40.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.144 -0.48 . . . . 72.349999999999994 110.889 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -123.57 18.05 9.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 64.349999999999994 110.938 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.572 HG22 ' O ' ' A' ' 51' ' ' PRO . 3.8 m -153.95 149.41 12.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.093 -0.503 . . . . 72.329999999999998 111.142 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.553 ' HB2' HD11 ' A' ' 7' ' ' LEU . 21.4 ttm180 -116.41 118.12 31.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.47 . . . . 72.219999999999999 110.897 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.598 HG23 HD21 ' A' ' 2' ' ' LEU . 24.3 mm -70.12 116.47 11.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 44.32 111.132 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.534 HG23 ' HG2' ' A' ' 56' ' ' ARG . 11.3 pt -134.71 172.02 16.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.479 . . . . 61.409999999999997 111.122 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -115.06 147.17 40.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.171 -0.468 . . . . 55.240000000000002 110.85 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.463 HD12 ' CE2' ' A' ' 3' ' ' PHE . 13.2 mt -72.59 -35.54 67.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.455 . . . . 71.549999999999997 110.932 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 21.1 mmt -81.93 -25.21 35.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.142 -0.481 . . . . 70.430000000000007 110.865 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -151.94 74.13 7.77 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.605 0.717 . . . . 73.099999999999994 110.88 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.63 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.8 Cg_endo -69.71 -8.62 24.07 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.662 2.241 . . . . 75.239999999999995 112.381 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.73 -14.77 25.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.195 -0.457 . . . . 42.210000000000001 111.071 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -75.01 -51.96 12.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.273 -0.421 . . . . 75.340000000000003 110.913 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.617 ' O ' HG12 ' A' ' 69' ' ' VAL . 83.8 m-85 -95.4 23.02 6.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 74.230000000000004 110.908 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.63 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -87.57 -21.17 25.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.118 -0.492 . . . . 72.140000000000001 111.113 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.6 t -95.37 -21.12 18.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.439 . . . . 72.540000000000006 110.865 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.874 HG21 HD11 ' A' ' 80' ' ' ILE . 10.7 p -51.57 149.22 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.116 -0.493 . . . . 72.340000000000003 111.133 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -99.32 105.77 17.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 73.129999999999995 110.835 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.741 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -68.37 -39.72 81.68 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.146 -0.479 . . . . 71.230000000000004 111.115 -179.874 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 35.2 t80 -54.05 -44.31 70.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 74.349999999999994 110.922 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.99 108.94 1.63 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 72.340000000000003 110.854 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.6 -25.18 37.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 74.120000000000005 110.839 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -66.48 -54.75 20.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.185 -0.462 . . . . 74.319999999999993 110.948 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -59.27 -57.09 14.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.079 -0.509 . . . . 64.349999999999994 110.943 179.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -52.66 -31.56 16.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 70.040000000000006 111.132 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.9 mtm -68.25 -54.31 18.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.135 -0.484 . . . . 62.25 110.849 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.0 mttm -55.69 -39.95 71.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.43 . . . . 75.209999999999994 110.857 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.874 HD11 HG21 ' A' ' 69' ' ' VAL . 67.4 mt -64.93 -54.36 30.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 53.200000000000003 111.108 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.669 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.9 mt -59.98 -29.65 43.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 74.219999999999999 111.128 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -70.76 -52.7 19.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 75.430000000000007 110.855 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.01 -31.37 71.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 72.420000000000002 110.898 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -81.32 -6.48 58.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.156 -0.475 . . . . 71.349999999999994 110.852 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 50.7 42.81 27.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.163 -0.471 . . . . 41.350000000000001 110.923 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.777 HD13 HD12 ' A' ' 2' ' ' LEU . 3.8 mt -81.01 119.06 74.95 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.665 0.745 . . . . 75.319999999999993 111.091 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.44 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 53.8 Cg_endo -69.77 155.8 64.97 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.699 2.266 . . . . 64.150000000000006 112.336 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.19 176.97 9.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.444 . . . . 55.43 111.129 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.8 t -57.67 -53.02 50.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.221 -0.445 . . . . 72.230000000000004 111.099 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -51.63 -49.19 62.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 61.329999999999998 110.887 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 67.6 mm-40 -58.82 -41.13 86.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 71.349999999999994 110.892 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 30.0 t90 -64.68 -42.61 95.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.195 -0.457 . . . . 71.430000000000007 110.911 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -61.98 -50.42 72.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.451 . . . . 75.209999999999994 110.915 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -61.43 -41.35 97.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 75.209999999999994 110.86 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -59.88 -51.07 71.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 74.409999999999997 110.855 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.1 p -64.32 -45.94 85.69 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.24 -0.436 . . . . 70.439999999999998 111.13 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -53.3 -53.02 57.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 74.310000000000002 110.936 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 51.9 mtt180 -67.42 -34.69 77.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 73.430000000000007 110.843 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -62.97 -38.44 91.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 75.510000000000005 110.913 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 5.4 mtpp -74.9 -25.71 59.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.131 -0.486 . . . . 71.430000000000007 110.879 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -89.18 175.1 7.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 72.230000000000004 110.911 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.8 t 53.92 40.07 31.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 62.32 110.851 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 15.5 m -79.94 -170.74 2.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 74.519999999999996 110.844 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 43.0 mm -51.48 -70.64 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 73.209999999999994 111.143 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -53.39 163.22 0.63 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.127 -0.488 . . . . 65.329999999999998 110.904 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 3.0 mt -118.47 132.08 69.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 63.409999999999997 111.1 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -114.26 -91.64 1.85 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.698 -0.763 . . . . 40.409999999999997 112.474 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -119.16 134.23 55.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.829 0.347 . . . . 74.540000000000006 110.912 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 99.85 -141.12 15.31 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.746 -0.74 . . . . 64.530000000000001 112.48 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 57.1 m80 -60.25 -176.87 0.05 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.884 0.373 . . . . 70.450000000000003 110.87 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -139.93 -86.12 0.12 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.777 -0.725 . . . . 75.140000000000001 112.526 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 21.1 mp0 -53.98 123.31 12.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.859 0.361 . . . . 74.420000000000002 110.939 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 66.7 m -144.84 153.72 41.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.233 -0.44 . . . . 73.010000000000005 110.832 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -54.33 126.8 24.63 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.108 -0.496 . . . . 70.340000000000003 110.91 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -86.28 103.48 2.8 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.748 -0.739 . . . . 35.43 112.497 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.613 HD12 ' N ' ' A' ' 117' ' ' GLU . 0.5 OUTLIER -115.77 -21.8 9.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.782 0.325 . . . . 50.450000000000003 110.915 -179.953 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.613 ' N ' HD12 ' A' ' 116' ' ' LEU . 9.7 tm-20 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 71.099999999999994 110.883 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' -9' ' ' GLY . . . . . 0.52 ' H2 ' HD11 ' B' ' -6' ' ' ILE . . . . . . . . 0 N--CA 1.451 -0.312 0 N-CA-C 112.441 -0.263 . . . . 75.430000000000007 112.441 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 3.5 pttm -111.97 -25.71 9.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.845 0.355 . . . . 74.140000000000001 110.917 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -72.04 -74.76 0.15 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 64.109999999999999 110.832 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' -6' ' ' ILE . . . . . 0.52 HD11 ' H2 ' ' B' ' -9' ' ' GLY . 23.8 mm 51.31 77.97 0.43 Allowed Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.632 0.729 . . . . 53.219999999999999 111.131 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 90.96 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.66 2.24 . . . . 53.420000000000002 112.32 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 16.3 t -102.79 34.56 2.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 72.019999999999996 110.853 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' -3' ' ' ARG . . . . . 0.427 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 3.3 mtp85 -95.31 160.3 30.97 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.554 0.693 . . . . 74.450000000000003 110.93 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' -2' ' ' PRO . . . . . 0.427 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.9 Cg_endo -69.78 102.51 1.04 Allowed 'Trans proline' 0 N--CA 1.466 -0.145 0 C-N-CA 122.718 2.279 . . . . 55.240000000000002 112.381 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -51.05 108.9 1.15 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.615 0.721 . . . . 64.299999999999997 111.139 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.71 150.94 69.18 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.745 2.297 . . . . 71.430000000000007 112.301 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -97.95 160.87 27.38 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.53 0.681 . . . . 73.120000000000005 110.92 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.76 167.88 23.16 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.649 2.232 . . . . 74.030000000000001 112.368 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 150.7 68.6 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.61 2.207 . . . . 73.519999999999996 112.373 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 46.1 m -109.07 172.71 6.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 53.310000000000002 110.854 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 19.4 t -116.28 -60.36 1.87 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.111 -0.495 . . . . 73.420000000000002 110.834 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.163 -0.472 . . . . 74.519999999999996 111.15 179.846 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 21.4 ptm . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.801 0.334 . . . . 54.340000000000003 110.844 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' -1' ' ' ALA . . . . . 0.574 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -146.09 160.43 43.05 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.548 0.689 . . . . 62.210000000000001 111.136 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.574 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.7 Cg_endo -69.79 78.75 1.0 Allowed 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.71 2.273 . . . . 71.209999999999994 112.329 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.768 HD11 HG13 ' A' ' 28' ' ' ILE . 0.6 OUTLIER -88.56 156.13 19.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.217 -0.447 . . . . 65.319999999999993 110.889 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.638 ' CD1' HD13 ' A' ' 60' ' ' LEU . 95.0 m-85 -134.65 140.01 45.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 74.319999999999993 110.902 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -111.24 169.76 8.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.485 . . . . 71.409999999999997 111.063 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.415 HG12 HG12 ' A' ' 58' ' ' ILE . 7.6 p -136.94 124.93 33.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.459 . . . . 61.520000000000003 111.1 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.773 HG21 HG11 ' A' ' 20' ' ' VAL . 0.2 OUTLIER -73.07 147.48 44.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 74.439999999999998 111.161 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.511 HD11 ' HB2' ' A' ' 56' ' ' ARG . 18.0 mt -118.14 -11.82 10.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.234 -0.439 . . . . 73.140000000000001 110.909 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -140.18 166.91 23.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 74.340000000000003 110.967 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -89.88 110.04 21.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 64.230000000000004 110.896 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.469 ' HB3' HG12 ' A' ' 20' ' ' VAL . 23.0 t80 -91.43 116.15 28.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 75.540000000000006 110.887 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.56 108.44 19.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.497 . . . . 72.140000000000001 110.878 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.27 158.98 15.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 75.25 111.09 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -124.68 -37.14 2.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.256 -0.429 . . . . 60.100000000000001 110.872 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.8 mmt180 -122.29 167.16 13.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.475 . . . . 75.5 110.875 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -53.63 -40.76 66.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 65.319999999999993 110.887 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -65.04 -25.35 67.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.254 -0.43 . . . . 75.319999999999993 110.858 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -90.29 129.07 36.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 72.409999999999997 110.909 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.561 HD13 ' O ' ' A' ' 46' ' ' GLY . 4.8 tp -108.29 145.07 34.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 61.030000000000001 110.879 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -89.09 150.26 22.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 75.319999999999993 110.876 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.773 HG11 HG21 ' A' ' 6' ' ' THR . 8.8 p -147.43 156.16 10.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 74.230000000000004 111.136 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 14.1 p -111.02 154.51 43.41 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.638 0.732 . . . . 54.340000000000003 110.879 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 128.17 15.66 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.691 2.261 . . . . 74.25 112.402 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.8 -2.93 60.48 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.794 -0.717 . . . . 63.030000000000001 112.521 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -85.6 158.41 20.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.846 0.355 . . . . 74.129999999999995 110.901 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.488 ' C ' HD22 ' A' ' 26' ' ' LEU . 3.4 m120 -101.39 131.95 47.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 71.409999999999997 110.903 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.819 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 3.1 mm? -123.66 159.97 28.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.161 -0.472 . . . . 74.140000000000001 110.918 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.81 112.88 25.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.446 . . . . 72.310000000000002 110.89 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.768 HG13 HD11 ' A' ' 2' ' ' LEU . 38.2 mm -70.88 143.27 14.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.126 -0.488 . . . . 71.349999999999994 111.169 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.2 m -122.92 -35.83 2.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 50.119999999999997 110.861 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.477 ' HB1' ' C ' ' A' ' 88' ' ' THR . . . -170.78 173.4 5.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 74.140000000000001 111.118 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.566 ' O ' HG23 ' A' ' 89' ' ' VAL . 1.8 p80 -128.12 176.18 7.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 73.109999999999999 110.859 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -137.78 99.86 4.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 73.209999999999994 110.902 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.5 t0 54.4 25.75 6.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.119 -0.491 . . . . 73.439999999999998 110.798 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.595 ' HD2' HD12 ' A' ' 81' ' ' ILE . 37.6 m-85 63.27 26.34 15.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.224 -0.443 . . . . 74.430000000000007 110.911 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.466 ' O ' HG23 ' A' ' 52' ' ' VAL . 16.9 mm-40 -115.64 -46.56 2.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.103 -0.499 . . . . 72.420000000000002 110.882 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.413 ' HB3' HD21 ' A' ' 49' ' ' LEU . 82.5 m95 -114.73 146.95 40.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.177 -0.465 . . . . 75.409999999999997 110.894 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.62 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -123.82 143.66 50.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 71.109999999999999 110.902 -179.999 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.45 HG21 ' CZ3' ' A' ' 92' ' ' TRP . 19.6 mm -101.22 98.49 6.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 43.439999999999998 111.131 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.819 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.86 138.36 47.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.155 -0.475 . . . . 62.420000000000002 111.131 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -112.59 157.56 39.94 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.571 0.7 . . . . 70.120000000000005 110.906 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 131.24 20.87 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.659 2.239 . . . . 62.020000000000003 112.388 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.468 HD12 ' CB ' ' A' ' 25' ' ' ASN . 35.9 mt -90.09 -31.95 5.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.227 -0.442 . . . . 74.120000000000005 111.134 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' A ASN . . . . . . . . . . . . . 11.4 t-20 -90.92 -53.7 4.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 73.209999999999994 110.865 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' B ARG . . . . . . . . . . . . . 22.7 mmt180 -61.05 -169.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 74.540000000000006 110.901 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.3 mt -92.76 -169.34 2.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 72.010000000000005 110.898 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.78 108.48 1.57 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.746 -0.74 . . . . 55.310000000000002 112.521 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.561 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -158.11 66.52 0.29 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.768 -0.73 . . . . 62.229999999999997 112.496 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.85 117.41 5.07 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.699 2.266 . . . . 63.039999999999999 112.312 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -117.68 -166.87 14.07 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.776 -0.726 . . . . 43.329999999999998 112.541 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.505 HD12 ' CD2' ' B' ' -7' ' ' PHE . 0.4 OUTLIER -120.9 124.83 45.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.897 0.38 . . . . 63.219999999999999 110.857 -179.898 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.435 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.2 p -134.94 133.13 20.75 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.635 0.731 . . . . 71.209999999999994 111.132 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.494 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.6 Cg_endo -69.75 153.87 68.44 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.721 2.281 . . . . 75.540000000000006 112.332 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.744 HG12 ' HB ' ' A' ' 71' ' ' THR . 11.8 t -65.55 -21.65 29.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.204 -0.453 . . . . 72.230000000000004 111.151 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 7.1 m -78.57 -1.86 36.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 62.140000000000001 110.8 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -121.38 2.18 10.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.185 -0.461 . . . . 62.229999999999997 110.921 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.494 HG22 ' O ' ' A' ' 51' ' ' PRO . 17.0 m -139.45 160.16 28.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.493 . . . . 62.310000000000002 111.111 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.511 ' HB2' HD11 ' A' ' 7' ' ' LEU . 17.9 ttm180 -127.26 123.64 36.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.167 -0.47 . . . . 71.540000000000006 110.862 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.482 HD11 ' CE2' ' A' ' 37' ' ' PHE . 24.8 mm -74.39 110.29 8.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.471 . . . . 35.109999999999999 111.129 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.449 HG23 ' HG2' ' A' ' 56' ' ' ARG . 6.7 pt -124.27 -177.87 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.155 -0.475 . . . . 75.319999999999993 111.138 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -128.64 145.9 51.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 71.549999999999997 110.908 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.638 HD13 ' CD1' ' A' ' 3' ' ' PHE . 1.5 mp -73.29 -38.3 65.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 71.209999999999994 110.926 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.83 -24.12 52.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 72.439999999999998 110.912 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -155.31 75.96 5.16 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.626 0.727 . . . . 73.439999999999998 110.856 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.718 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 54.3 Cg_endo -69.72 -8.32 23.31 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.663 2.242 . . . . 64.329999999999998 112.367 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.81 -15.36 23.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.447 . . . . 44.310000000000002 111.085 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -77.73 -51.66 10.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.252 -0.431 . . . . 64.329999999999998 110.914 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.429 ' HA ' HG23 ' A' ' 69' ' ' VAL . 57.1 m-85 -95.35 23.15 6.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.255 -0.429 . . . . 74.450000000000003 110.915 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.718 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -88.03 -23.81 23.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.095 -0.502 . . . . 70.209999999999994 111.1 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 13.0 p -91.68 -9.72 42.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 65.310000000000002 110.835 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.429 HG23 ' HA ' ' A' ' 66' ' ' TYR . 55.2 t -51.49 139.94 6.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.14 -0.482 . . . . 65.5 111.101 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -94.77 75.42 3.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.476 . . . . 73.409999999999997 110.867 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.744 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -46.92 -34.58 5.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 65.430000000000007 111.127 -179.886 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -57.94 -45.19 86.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 71.319999999999993 110.903 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -69.67 114.82 8.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 74.530000000000001 110.903 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.08 -23.98 37.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.214 -0.448 . . . . 71.010000000000005 110.858 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -66.81 -57.68 6.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 74.209999999999994 110.843 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.692 ' O ' HD12 ' A' ' 80' ' ' ILE . 4.2 mm-40 -57.64 -57.59 12.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 70.030000000000001 110.944 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.7 p -51.43 -32.12 12.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 72.219999999999999 111.162 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.7 mtm -68.17 -51.64 43.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.476 . . . . 73.400000000000006 110.852 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.9 mttm -55.83 -42.67 76.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 74.019999999999996 110.904 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.692 HD12 ' O ' ' A' ' 76' ' ' GLN . 1.6 mp -64.79 -55.04 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 53.030000000000001 111.149 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.595 HD12 ' HD2' ' A' ' 34' ' ' TYR . 90.5 mt -57.7 -37.53 59.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 74.340000000000003 111.087 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -71.08 -52.02 21.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 73.420000000000002 110.896 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -58.94 -51.35 70.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 65.340000000000003 110.844 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -68.66 -14.1 62.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.145 -0.479 . . . . 71.530000000000001 110.883 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? 58.76 54.23 5.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 74.510000000000005 110.914 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.537 ' HB ' HG23 ' A' ' 81' ' ' ILE . 22.6 mt -81.74 131.19 58.3 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.655 0.74 . . . . 75.239999999999995 111.134 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 158.23 57.66 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.685 2.257 . . . . 71.219999999999999 112.363 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.477 ' C ' ' HB1' ' A' ' 30' ' ' ALA . 0.1 OUTLIER -85.37 169.94 13.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 74.200000000000003 111.164 -179.957 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.829 HG12 ' HE2' ' A' ' 93' ' ' LYS . 25.4 t -51.51 -52.04 22.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 71.329999999999998 111.116 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -59.87 -47.48 85.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 42.130000000000003 110.891 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -57.48 -27.84 62.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.127 -0.488 . . . . 45.009999999999998 110.94 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.45 ' CZ3' HG21 ' A' ' 38' ' ' ILE . 26.8 t90 -73.27 -48.01 38.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 72.530000000000001 110.94 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.829 ' HE2' HG12 ' A' ' 89' ' ' VAL . 11.6 mtmt -64.86 -39.97 94.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.219 -0.446 . . . . 75.129999999999995 110.905 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -70.23 -43.51 70.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.464 . . . . 72.319999999999993 110.867 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 39.7 mm-40 -61.37 -45.96 92.19 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.18 -0.464 . . . . 72.109999999999999 110.917 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.3 p -68.67 -40.92 79.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 73.310000000000002 111.141 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.2 mmt85 -62.96 -37.46 87.17 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.178 -0.465 . . . . 72.230000000000004 110.899 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -84.62 -23.96 29.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 64.140000000000001 110.88 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -82.84 -23.45 33.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.183 -0.462 . . . . 74.129999999999995 110.898 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 2.9 mptp? -97.02 -18.87 19.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.125 -0.489 . . . . 74.420000000000002 110.946 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -53.86 174.91 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.461 . . . . 65.120000000000005 110.9 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.3 m 63.38 42.35 6.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.156 -0.474 . . . . 74.510000000000005 110.87 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 16.0 m -74.66 -168.94 0.77 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.118 -0.492 . . . . 74.209999999999994 110.888 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.448 HG22 ' N ' ' A' ' 105' ' ' GLN . 10.3 mt -79.86 158.66 4.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.151 -0.477 . . . . 73.329999999999998 111.154 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.448 ' N ' HG22 ' A' ' 104' ' ' ILE . 6.6 pt20 -48.86 157.54 0.39 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 50.240000000000002 110.9 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -147.19 179.93 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.454 . . . . 73.140000000000001 111.124 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -54.51 -77.79 0.14 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.772 -0.728 . . . . 74.329999999999998 112.473 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -113.9 150.05 34.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.862 0.363 . . . . 73.129999999999995 110.908 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -156.98 -120.75 0.65 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.74 -0.743 . . . . 64.319999999999993 112.477 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -54.41 171.04 0.13 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.823 0.344 . . . . 72.319999999999993 110.845 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -160.05 167.52 35.47 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.725 -0.75 . . . . 60.329999999999998 112.491 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -51.34 134.43 28.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.798 0.332 . . . . 63.140000000000001 110.901 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 7.4 p -99.45 -177.92 3.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.437 . . . . 72.109999999999999 110.826 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -147.78 149.44 32.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.094 -0.503 . . . . 73.540000000000006 110.891 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -111.03 132.54 11.0 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.757 -0.735 . . . . 52.030000000000001 112.522 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.462 ' H ' HD12 ' A' ' 116' ' ' LEU . 0.6 OUTLIER -102.72 -65.03 1.02 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.804 0.335 . . . . 65.420000000000002 110.931 -179.927 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 14.3 tm-20 . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.128 -0.487 . . . . 65.430000000000007 110.891 179.937 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' -9' ' ' GLY . . . . . 0.637 ' HA3' HD11 ' B' ' -6' ' ' ILE . . . . . . . . 0 N--CA 1.451 -0.353 0 N-CA-C 112.521 -0.231 . . . . 74.430000000000007 112.521 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -92.66 -45.61 7.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.813 0.34 . . . . 74.219999999999999 110.913 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' -7' ' ' PHE . . . . . 0.505 ' CD2' HD12 ' A' ' 49' ' ' LEU . 28.8 m-85 -84.79 -75.04 0.37 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 73.25 110.837 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' -6' ' ' ILE . . . . . 0.637 HD11 ' HA3' ' B' ' -9' ' ' GLY . 27.9 mm 51.39 76.21 0.57 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.573 0.701 . . . . 43.299999999999997 111.153 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 104.58 1.34 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.693 2.262 . . . . 75.120000000000005 112.354 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 31.0 t -96.47 5.08 51.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 54.409999999999997 110.829 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -51.68 162.15 0.78 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.637 0.732 . . . . 74.319999999999993 110.891 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -19.09 36.76 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.669 2.246 . . . . 74.109999999999999 112.357 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 63.69 82.6 0.21 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.628 0.728 . . . . 62.439999999999998 111.117 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 140.75 43.47 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.681 2.254 . . . . 53.109999999999999 112.349 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 26.3 mtmm -72.14 160.72 81.95 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.582 0.706 . . . . 55.350000000000001 110.889 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 167.75 23.54 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.704 2.269 . . . . 64.019999999999996 112.329 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 86.5 0.58 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.638 2.226 . . . . 65.450000000000003 112.367 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 61.4 p -91.07 -175.75 4.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 52.020000000000003 110.858 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.2 -33.67 20.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.112 -0.495 . . . . 51.520000000000003 110.874 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 72.430000000000007 111.082 179.91 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.763 0.316 . . . . 61.530000000000001 110.88 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' -1' ' ' ALA . . . . . 0.588 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -104.12 160.38 26.26 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.562 0.696 . . . . 75.140000000000001 111.113 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.588 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.7 Cg_endo -69.74 131.97 22.37 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.684 2.256 . . . . 70.540000000000006 112.342 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.5 pp -134.18 145.35 49.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.214 -0.448 . . . . 73.230000000000004 110.885 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -128.97 148.17 50.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 71.299999999999997 110.902 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.439 ' HB2' ' CD1' ' A' ' 28' ' ' ILE . . . -122.7 168.6 12.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.137 -0.483 . . . . 73.25 111.09 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.4 p -134.27 130.17 54.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 64.109999999999999 111.127 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.738 HG21 HG11 ' A' ' 20' ' ' VAL . 0.9 OUTLIER -72.74 142.47 48.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 73.430000000000007 111.143 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.74 HD11 ' HB2' ' A' ' 56' ' ' ARG . 5.7 mt -117.6 -17.1 10.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.452 . . . . 70.430000000000007 110.91 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -129.29 167.95 16.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.178 -0.465 . . . . 74.140000000000001 110.949 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -92.14 112.19 24.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.119 -0.491 . . . . 74.239999999999995 110.868 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -92.17 123.16 35.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.129 -0.487 . . . . 72.010000000000005 110.92 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.9 mttt -101.96 101.01 11.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 75.230000000000004 110.958 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.451 ' HB1' ' HB3' ' A' ' 17' ' ' GLU . . . -61.17 155.65 20.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.439 . . . . 72.299999999999997 111.109 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -122.72 -35.99 2.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 75.219999999999999 110.841 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -121.67 -176.49 3.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.156 -0.475 . . . . 71.099999999999994 110.844 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -68.23 -38.45 81.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 65.109999999999999 110.855 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -63.7 -32.95 74.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 71.140000000000001 110.846 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.451 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 0.6 OUTLIER -79.3 147.71 32.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.436 . . . . 75.340000000000003 110.846 -179.888 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.413 HD22 ' HA3' ' A' ' 48' ' ' GLY . 8.7 tp -127.5 121.6 31.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.113 -0.494 . . . . 74.140000000000001 110.909 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -77.32 144.07 38.32 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.236 -0.438 . . . . 72.219999999999999 110.882 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.738 HG11 HG21 ' A' ' 6' ' ' THR . 7.0 p -149.89 154.71 8.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 62.140000000000001 111.176 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.0 m -105.84 156.14 37.11 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.715 0.769 . . . . 74.439999999999998 110.864 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.86 139.88 40.96 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.703 2.269 . . . . 74.0 112.341 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.35 -4.99 74.32 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.741 -0.742 . . . . 64.040000000000006 112.461 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -89.54 146.08 24.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.868 0.366 . . . . 74.340000000000003 110.918 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -89.76 123.7 33.99 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 65.409999999999997 110.884 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.782 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 3.3 mm? -116.08 145.64 42.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 72.430000000000007 110.877 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.2 t -101.24 112.89 25.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.154 -0.475 . . . . 45.350000000000001 110.862 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.439 ' CD1' ' HB2' ' A' ' 4' ' ' ALA . 56.6 mt -78.36 144.57 11.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.099 -0.5 . . . . 74.420000000000002 111.141 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.2 m -117.95 -41.94 2.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.18 -0.464 . . . . 73.400000000000006 110.837 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.37 175.35 14.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 54.210000000000001 111.081 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.411 ' O ' HG22 ' A' ' 88' ' ' THR . 2.4 p80 -127.22 178.52 5.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 75.439999999999998 110.838 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -150.88 107.22 3.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.212 -0.449 . . . . 74.430000000000007 110.951 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 57.62 20.07 5.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.143 -0.481 . . . . 73.409999999999997 110.906 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.636 ' HD2' HD12 ' A' ' 81' ' ' ILE . 32.7 m-85 58.84 21.88 9.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 72.329999999999998 110.912 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -118.17 -24.81 6.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 71.120000000000005 110.866 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -130.23 135.87 48.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 73.230000000000004 110.903 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.614 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -118.56 138.79 52.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.254 -0.43 . . . . 74.439999999999998 110.859 -179.942 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.2 mm -93.77 94.17 4.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 71.450000000000003 111.119 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.782 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -109.97 149.64 29.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 73.319999999999993 111.11 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.2 pttp -124.9 158.01 64.42 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.576 0.703 . . . . 74.439999999999998 110.913 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 153.94 68.29 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.671 2.248 . . . . 73.109999999999999 112.343 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.416 ' O ' HG22 ' A' ' 42' ' ' ILE . 29.0 mt -120.03 -9.51 10.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 72.010000000000005 111.118 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' A ASN . . . . . . . . . . . . . 27.7 m-20 -118.1 -49.36 2.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 72.329999999999998 110.874 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' B ARG . . . . . 0.658 ' C ' HD12 ' A' ' 44' ' ' LEU . 1.2 mtm105 -51.52 -70.02 0.1 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 74.209999999999994 110.878 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.658 HD12 ' C ' ' A' ' 43' B ARG . 5.5 mp -151.64 -75.8 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 75.329999999999998 110.903 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 142.08 66.04 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.808 -0.71 . . . . 73.430000000000007 112.538 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -122.51 154.49 16.94 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.756 -0.735 . . . . 71.120000000000005 112.51 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 114.19 3.62 Favored 'Trans proline' 0 N--CA 1.465 -0.16 0 C-N-CA 122.719 2.279 . . . . 52.310000000000002 112.351 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.413 ' HA3' HD22 ' A' ' 18' ' ' LEU . . . -121.79 163.69 15.15 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.697 -0.763 . . . . 34.43 112.476 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.558 HD12 ' HB3' ' B' ' -7' ' ' PHE . 1.0 OUTLIER -108.89 124.68 51.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.853 0.359 . . . . 73.299999999999997 110.933 -179.938 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.444 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.2 p -143.3 133.21 11.94 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.665 0.745 . . . . 53.229999999999997 111.119 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.444 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.2 Cg_endo -69.76 152.42 69.29 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.707 2.271 . . . . 52.439999999999998 112.284 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.73 HG12 ' HB ' ' A' ' 71' ' ' THR . 12.4 t -64.92 -20.75 28.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 60.130000000000003 111.132 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.6 m -79.56 0.41 29.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 74.409999999999997 110.837 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.402 ' CD1' ' HG2' ' A' ' 51' ' ' PRO . 27.5 m-85 -127.63 18.61 6.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 72.200000000000003 110.926 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.5 m -151.9 160.29 3.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.097 -0.501 . . . . 74.430000000000007 111.109 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.74 ' HB2' HD11 ' A' ' 7' ' ' LEU . 20.1 ttp180 -123.62 129.43 51.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 74.150000000000006 110.885 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 44.6 mm -81.89 111.95 19.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 72.430000000000007 111.169 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.589 HG23 ' HG2' ' A' ' 56' ' ' ARG . 13.6 pt -129.98 -178.28 2.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 54.450000000000003 111.125 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -129.15 129.63 45.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.189 -0.46 . . . . 75.310000000000002 110.85 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.4 mt -55.19 -26.2 37.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 64.510000000000005 110.89 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.51 -30.77 16.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 72.109999999999999 110.873 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -141.05 73.92 26.03 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.578 0.704 . . . . 75.450000000000003 110.862 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.641 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.8 Cg_endo -69.8 -13.77 35.02 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.66 2.24 . . . . 64.349999999999994 112.312 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.99 -16.14 20.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.237 -0.438 . . . . 61.329999999999998 111.122 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.9 ttmt -74.26 -52.17 13.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 73.25 110.89 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.618 ' O ' HG12 ' A' ' 69' ' ' VAL . 68.0 m-85 -95.41 23.17 6.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.195 -0.457 . . . . 64.420000000000002 110.931 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.641 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -87.0 -18.76 29.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 52.240000000000002 111.068 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.3 p -95.93 -21.22 18.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.24 -0.436 . . . . 64.040000000000006 110.825 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.937 HG21 HD11 ' A' ' 80' ' ' ILE . 9.6 p -51.45 145.54 2.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.138 -0.483 . . . . 71.409999999999997 111.107 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.44 106.43 18.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.173 -0.467 . . . . 71.049999999999997 110.852 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.73 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -70.59 -35.79 73.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 74.450000000000003 111.097 -179.861 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -60.66 -41.52 95.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.186 -0.461 . . . . 70.420000000000002 110.928 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 57.4 t0 -63.94 107.85 1.34 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.138 -0.483 . . . . 72.430000000000007 110.854 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.15 -27.08 31.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 61.240000000000002 110.868 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -67.15 -55.26 14.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 65.329999999999998 110.912 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -59.71 -56.58 20.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 71.219999999999999 110.879 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.48 ' HA ' HD12 ' A' ' 80' ' ' ILE . 2.4 p -52.81 -31.7 16.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 51.210000000000001 111.131 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 11.4 mtm -68.02 -56.08 10.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 61.049999999999997 110.932 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 41.1 mttm -54.84 -36.96 65.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 75.439999999999998 110.919 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.937 HD11 HG21 ' A' ' 69' ' ' VAL . 27.0 mt -66.91 -55.18 18.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 71.120000000000005 111.116 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.701 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.9 mt -60.57 -36.05 67.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.461 . . . . 72.120000000000005 111.092 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -71.27 -50.17 35.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 74.530000000000001 110.864 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -62.82 -47.04 85.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 62.210000000000001 110.884 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -70.72 -14.08 62.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 63.219999999999999 110.908 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.85 54.94 4.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.483 . . . . 74.439999999999998 110.856 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.701 ' HB ' HG23 ' A' ' 81' ' ' ILE . 49.9 mt -85.12 132.18 46.27 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.602 0.715 . . . . 62.229999999999997 111.125 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 161.07 47.36 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.671 2.247 . . . . 65.120000000000005 112.361 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.411 HG22 ' O ' ' A' ' 31' ' ' HIS . 0.2 OUTLIER -97.31 165.67 11.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.248 -0.433 . . . . 73.420000000000002 111.203 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 87.2 t -50.84 -52.66 16.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.262 -0.427 . . . . 60.32 111.112 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -52.22 -52.17 53.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 72.019999999999996 110.931 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -58.04 -42.75 86.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.148 -0.478 . . . . 74.430000000000007 110.912 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.434 ' O ' HG23 ' A' ' 96' ' ' THR . 55.5 t90 -65.32 -36.26 83.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.219 -0.446 . . . . 73.120000000000005 110.94 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? -68.29 -37.82 81.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 64.540000000000006 110.907 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -69.81 -50.52 42.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 62.530000000000001 110.885 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.4 ' HG2' ' HA ' ' A' ' 92' ' ' TRP . 4.3 pt20 -59.89 -39.66 86.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 74.349999999999994 110.901 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.434 HG23 ' O ' ' A' ' 92' ' ' TRP . 30.8 p -70.43 -41.1 73.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 73.319999999999993 111.163 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -60.9 -45.26 95.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 73.120000000000005 110.915 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -75.67 -31.11 59.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.48 . . . . 73.099999999999994 110.839 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 50.1 t80 -71.77 -38.69 70.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.225 -0.443 . . . . 72.310000000000002 110.891 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.6 mtpp -66.68 -14.48 62.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.13 -0.486 . . . . 72.510000000000005 110.881 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -60.17 -169.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.282 -0.417 . . . . 74.439999999999998 110.842 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 88.1 p -48.96 105.55 0.08 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.485 . . . . 53.210000000000001 110.843 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 4.3 m -158.18 -169.3 2.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.116 -0.493 . . . . 51.310000000000002 110.867 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.463 HG22 ' N ' ' A' ' 105' ' ' GLN . 19.6 mt -73.63 156.49 6.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 71.239999999999995 111.134 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.609 ' O ' HD13 ' A' ' 106' ' ' ILE . 22.4 mt-30 -49.42 166.41 0.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 53.130000000000003 110.934 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.609 HD13 ' O ' ' A' ' 105' ' ' GLN . 25.3 mm -137.07 -69.12 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.219 -0.446 . . . . 75.219999999999999 111.114 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 153.01 -33.8 0.79 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.76 -0.733 . . . . 65.230000000000004 112.515 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -119.42 149.93 41.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.881 0.372 . . . . 75.310000000000002 110.905 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -152.57 145.62 13.37 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.696 -0.764 . . . . 61.25 112.468 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 29.3 m80 -153.66 -179.47 7.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.783 0.325 . . . . 65.120000000000005 110.911 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 174.03 145.02 5.03 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.761 -0.733 . . . . 74.040000000000006 112.492 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -146.74 179.88 7.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.802 0.334 . . . . 73.209999999999994 110.93 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 35.4 m -163.05 157.97 21.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 75.219999999999999 110.871 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -148.19 178.62 8.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.164 -0.471 . . . . 71.150000000000006 110.923 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 154.94 117.66 0.61 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.768 -0.73 . . . . 53.039999999999999 112.486 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.408 ' O ' HD12 ' A' ' 116' ' ' LEU . 0.6 OUTLIER -165.06 158.24 16.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.806 0.336 . . . . 71.200000000000003 110.875 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.149 -0.478 . . . . 53.340000000000003 110.897 179.902 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 N-CA-C 112.476 -0.25 . . . . 51.229999999999997 112.476 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 22.8 mtpt -86.14 -39.2 16.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.842 0.354 . . . . 71.129999999999995 110.909 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' -7' ' ' PHE . . . . . 0.558 ' HB3' HD12 ' A' ' 49' ' ' LEU . 31.3 m-85 -94.27 -76.58 0.48 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.45 . . . . 72.430000000000007 110.896 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 22.1 mm 50.25 78.22 0.41 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.611 0.719 . . . . 55.109999999999999 111.14 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 97.09 0.62 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.661 2.241 . . . . 64.439999999999998 112.337 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 28.7 t -95.99 3.28 53.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.197 -0.456 . . . . 70.140000000000001 110.863 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.54 162.39 0.71 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.637 0.732 . . . . 74.25 110.874 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 -17.94 37.17 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.674 2.249 . . . . 71.519999999999996 112.322 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 63.89 84.04 0.19 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.618 0.723 . . . . 60.030000000000001 111.097 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 140.01 41.79 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.696 2.264 . . . . 64.019999999999996 112.36 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -73.6 160.59 81.87 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.602 0.715 . . . . 73.040000000000006 110.909 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 167.1 25.47 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.667 2.245 . . . . 74.219999999999999 112.323 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.7 -31.41 20.86 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 122.703 2.269 . . . . 74.109999999999999 112.401 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 19.4 m -97.47 64.32 1.84 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 50.32 110.831 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 7.3 t -70.3 127.23 32.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.14 -0.482 . . . . 60.409999999999997 110.854 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.494 . . . . 54.350000000000001 111.071 179.937 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.76 0.314 . . . . 70.299999999999997 110.903 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' -1' ' ' ALA . . . . . 0.588 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -137.33 160.37 65.84 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.566 0.698 . . . . 53.399999999999999 111.071 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.588 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.4 Cg_endo -69.76 140.84 43.65 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.715 2.277 . . . . 54.149999999999999 112.324 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.568 ' CD1' HD12 ' A' ' 28' ' ' ILE . 1.1 pp -140.41 147.27 39.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 75.319999999999993 110.924 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -126.03 156.65 39.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 61.140000000000001 110.848 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.924 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -133.43 156.05 48.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 63.0 111.088 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.473 HG13 ' HB3' ' A' ' 56' ' ' ARG . 6.1 p -123.36 121.63 63.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 73.439999999999998 111.187 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.703 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -64.95 140.73 58.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 75.329999999999998 111.169 -179.952 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.76 HD11 ' HB2' ' A' ' 56' ' ' ARG . 8.2 mt -116.71 -13.87 10.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.262 -0.426 . . . . 73.319999999999993 110.923 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -134.98 158.58 43.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.172 -0.467 . . . . 72.099999999999994 110.939 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.56 105.22 14.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.117 -0.492 . . . . 64.030000000000001 110.897 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -86.64 132.86 33.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.159 -0.473 . . . . 74.430000000000007 110.904 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.01 98.61 7.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 62.130000000000003 110.873 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.13 159.45 1.25 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.426 . . . . 60.149999999999999 111.096 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -116.4 -23.93 8.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 52.109999999999999 110.895 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.5 mmm-85 -141.14 -177.51 5.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 74.319999999999993 110.86 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -58.18 -46.08 86.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 65.140000000000001 110.875 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -52.32 -52.65 51.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 74.25 110.844 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.9 mp0 -67.01 151.16 48.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 50.43 110.872 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.0 tp -125.87 151.71 46.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.155 -0.475 . . . . 75.230000000000004 110.886 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -95.13 142.25 27.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 54.32 110.867 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.736 HG21 HD11 ' A' ' 26' ' ' LEU . 14.6 p -152.45 150.14 13.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.18 -0.464 . . . . 74.129999999999995 111.128 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.3 m -105.96 159.64 28.94 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.682 0.753 . . . . 73.230000000000004 110.84 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.68 121.82 8.52 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.732 2.288 . . . . 62.399999999999999 112.363 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.13 1.77 31.58 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.68 -0.771 . . . . 71.109999999999999 112.483 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -92.14 156.96 16.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.855 0.359 . . . . 60.520000000000003 110.869 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -100.88 131.69 46.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.48 . . . . 72.409999999999997 110.921 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.736 HD11 HG21 ' A' ' 20' ' ' VAL . 4.7 mp -130.83 146.27 52.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.207 -0.451 . . . . 70.140000000000001 110.896 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.14 115.97 31.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 72.120000000000005 110.876 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.924 HD11 ' HB2' ' A' ' 4' ' ' ALA . 43.9 mt -80.8 150.46 4.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 74.120000000000005 111.12 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 24.7 m -123.93 -41.7 2.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 55.43 110.868 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -154.63 -178.42 7.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 54.32 111.124 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.619 ' O ' HG23 ' A' ' 89' ' ' VAL . 1.8 p80 -134.62 175.25 9.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 73.450000000000003 110.858 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.466 ' OH ' HG23 ' B' ' -6' ' ' ILE . 33.4 t80 -137.39 100.29 4.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.233 -0.44 . . . . 73.540000000000006 110.929 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 55.58 25.63 8.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.098 -0.501 . . . . 74.0 110.886 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.57 ' HD2' HD12 ' A' ' 81' ' ' ILE . 35.0 m-85 63.61 16.4 9.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 73.129999999999995 110.935 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.627 ' O ' HG23 ' A' ' 52' ' ' VAL . 10.0 mm-40 -104.03 -54.89 2.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.123 -0.489 . . . . 54.25 110.886 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 39.1 m95 -105.65 151.7 24.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.156 -0.475 . . . . 75.140000000000001 110.935 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.8 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -124.75 135.89 53.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 62.240000000000002 110.874 -179.958 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.7 mm -93.13 95.98 5.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 71.439999999999998 111.136 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.547 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -113.79 153.96 28.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 71.099999999999994 111.109 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 ptmt -126.73 157.6 70.76 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.568 0.699 . . . . 64.120000000000005 110.882 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 130.92 20.22 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.666 2.244 . . . . 75.329999999999998 112.346 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 76.9 mt -98.76 -38.18 6.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.427 . . . . 62.340000000000003 111.11 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' A ASN . . . . . . . . . . . . . 40.1 t-20 -101.68 -36.5 8.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 71.319999999999993 110.893 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' B ARG . . . . . 0.661 ' C ' HD22 ' A' ' 44' ' ' LEU . 5.0 mmp_? -71.18 -176.96 1.57 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 74.400000000000006 110.84 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.661 HD22 ' C ' ' A' ' 43' B ARG . 4.2 mm? -128.15 121.8 30.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 74.219999999999999 110.907 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 172.03 -107.65 0.26 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.726 -0.75 . . . . 41.329999999999998 112.501 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -173.63 172.91 45.58 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.74 -0.743 . . . . 74.450000000000003 112.487 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.81 124.74 11.36 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.694 2.263 . . . . 73.230000000000004 112.304 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -116.11 -122.46 3.44 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.728 -0.749 . . . . 23.129999999999999 112.471 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -153.69 124.79 7.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.837 0.351 . . . . 41.439999999999998 110.932 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.0 p -134.87 132.76 20.6 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.646 0.736 . . . . 72.200000000000003 111.152 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.474 ' O ' HG22 ' A' ' 55' ' ' VAL . 54.0 Cg_endo -69.7 150.49 68.67 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.711 2.274 . . . . 74.420000000000002 112.381 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.8 HG22 ' CD2' ' A' ' 37' ' ' PHE . 52.9 t -58.17 -22.6 19.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 75.510000000000005 111.134 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -77.93 -3.89 44.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 74.0 110.829 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.639 ' O ' HG22 ' A' ' 6' ' ' THR . 14.9 m-85 -122.25 18.6 10.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.465 . . . . 73.230000000000004 110.935 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.474 HG22 ' O ' ' A' ' 51' ' ' PRO . 3.8 m -153.92 140.07 11.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 71.319999999999993 111.097 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.76 ' HB2' HD11 ' A' ' 7' ' ' LEU . 20.2 ttm180 -112.87 117.01 30.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 71.510000000000005 110.861 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 31.3 mm -66.84 109.18 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.206 -0.452 . . . . 74.5 111.129 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.566 HG23 ' HG2' ' A' ' 56' ' ' ARG . 3.5 pt -130.91 170.09 20.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 74.409999999999997 111.18 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -114.41 141.24 47.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.197 -0.456 . . . . 62.039999999999999 110.846 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.29 -24.99 66.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 63.219999999999999 110.92 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.85 -28.98 17.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 74.129999999999995 110.87 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -148.73 73.6 10.47 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.59 0.709 . . . . 53.140000000000001 110.839 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.586 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.2 Cg_endo -69.79 -10.87 29.59 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.709 2.273 . . . . 70.409999999999997 112.331 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.69 -12.67 33.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 72.409999999999997 111.095 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.6 ttmm -74.44 -52.06 13.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.459 . . . . 74.150000000000006 110.905 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.533 ' HA ' HG23 ' A' ' 69' ' ' VAL . 73.4 m-85 -98.38 23.11 8.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 71.140000000000001 110.926 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.586 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -81.43 -21.97 38.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.108 -0.497 . . . . 65.409999999999997 111.08 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.2 t -96.96 -12.68 23.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 65.200000000000003 110.829 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.533 HG23 ' HA ' ' A' ' 66' ' ' TYR . 55.4 t -51.44 141.73 4.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 63.020000000000003 111.157 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -91.35 76.13 5.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.173 -0.467 . . . . 71.140000000000001 110.875 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.577 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -47.51 -34.91 8.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.185 -0.462 . . . . 64.209999999999994 111.143 -179.864 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -60.17 -44.24 95.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 71.129999999999995 110.953 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -63.87 113.47 3.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.088 -0.506 . . . . 73.439999999999998 110.886 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.06 -24.13 37.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 73.439999999999998 110.866 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -66.3 -57.4 7.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 64.510000000000005 110.895 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -57.61 -56.07 26.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 65.349999999999994 110.913 -179.951 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -53.41 -31.32 18.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 71.420000000000002 111.128 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 7.8 mtm -68.35 -55.54 11.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.484 . . . . 73.439999999999998 110.863 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 48.2 mttt -54.53 -39.04 67.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.262 -0.426 . . . . 71.150000000000006 110.894 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.479 HD11 HG11 ' A' ' 69' ' ' VAL . 70.4 mt -65.71 -58.22 7.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 65.099999999999994 111.079 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.731 HG23 ' HB ' ' A' ' 86' ' ' ILE . 97.8 mt -57.79 -35.17 50.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 72.299999999999997 111.127 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -70.77 -52.01 23.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.153 -0.476 . . . . 44.450000000000003 110.836 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -61.28 -49.4 77.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 74.310000000000002 110.892 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -68.9 -14.5 63.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 74.510000000000005 110.881 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.65 55.57 4.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 72.150000000000006 110.902 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.731 ' HB ' HG23 ' A' ' 81' ' ' ILE . 39.0 mt -84.9 132.07 47.11 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 121.671 0.748 . . . . 63.450000000000003 111.16 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 151.33 68.78 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.634 2.223 . . . . 74.200000000000003 112.389 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -85.55 168.29 14.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.43 . . . . 73.150000000000006 111.167 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.619 HG23 ' O ' ' A' ' 31' ' ' HIS . 71.1 t -51.66 -58.12 2.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 63.039999999999999 111.108 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -52.02 -51.65 55.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 71.120000000000005 110.874 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 40.1 mm-40 -57.02 -41.07 77.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.156 -0.475 . . . . 45.399999999999999 110.878 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.446 ' O ' HG23 ' A' ' 96' ' ' THR . 34.8 t90 -66.93 -38.02 85.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.251 -0.431 . . . . 73.219999999999999 110.932 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -68.12 -35.47 78.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 73.439999999999998 110.926 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -71.79 -49.85 35.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 61.539999999999999 110.912 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.407 ' HG2' ' HA ' ' A' ' 92' ' ' TRP . 21.0 pt20 -61.03 -39.93 91.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 63.420000000000002 110.891 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.446 HG23 ' O ' ' A' ' 92' ' ' TRP . 38.8 p -70.9 -42.64 69.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 52.539999999999999 111.157 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 1.1 mmm180 -62.2 -38.82 90.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 63.119999999999997 110.896 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 59.4 mtp180 -80.61 -30.25 36.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 73.409999999999997 110.851 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -78.32 -22.54 47.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 74.25 110.934 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 11.7 mmmt -91.46 -23.7 19.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.09 -0.504 . . . . 71.019999999999996 110.896 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -89.25 9.43 25.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.21 -0.45 . . . . 63.329999999999998 110.917 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.5 m 51.48 47.72 24.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.098 -0.501 . . . . 64.420000000000002 110.855 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 90.0 p -70.99 -169.02 0.32 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 72.340000000000003 110.881 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.443 HG22 ' N ' ' A' ' 105' ' ' GLN . 9.5 mt -79.99 158.78 4.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.16 -0.473 . . . . 74.439999999999998 111.123 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.443 ' N ' HG22 ' A' ' 104' ' ' ILE . 6.8 pt20 -49.69 166.7 0.05 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 44.219999999999999 110.916 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.1 mp -119.34 -60.61 2.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 63.539999999999999 111.144 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -157.28 57.71 0.37 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.741 -0.742 . . . . 73.049999999999997 112.494 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -88.77 122.26 31.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.88 0.371 . . . . 71.349999999999994 110.935 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 164.46 151.92 6.75 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.789 -0.72 . . . . 72.549999999999997 112.534 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -172.79 154.76 3.03 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.775 0.321 . . . . 75.310000000000002 110.903 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -102.13 -157.65 26.19 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.779 -0.724 . . . . 75.239999999999995 112.508 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -173.85 141.46 0.81 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.85 0.357 . . . . 72.030000000000001 110.898 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 64.2 m -78.92 -176.05 4.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 75.109999999999999 110.865 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -144.54 143.55 30.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 75.040000000000006 110.946 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -131.84 115.79 1.75 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.718 -0.754 . . . . 74.319999999999993 112.512 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -153.53 174.3 14.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.794 0.33 . . . . 73.239999999999995 110.867 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 55.549999999999997 110.915 179.946 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 N-CA-C 112.455 -0.258 . . . . 43.43 112.455 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' -8' ' ' LYS . . . . . 0.639 ' C ' HD12 ' B' ' -6' ' ' ILE . 0.1 OUTLIER -156.29 175.58 13.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.766 0.317 . . . . 74.340000000000003 110.924 -179.966 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 59.82 26.33 15.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.243 -0.435 . . . . 72.349999999999994 110.863 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' -6' ' ' ILE . . . . . 0.639 HD12 ' C ' ' B' ' -8' ' ' LYS . 3.0 mp -78.26 116.47 59.28 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.608 0.718 . . . . 73.420000000000002 111.141 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 -49.58 0.55 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.679 2.253 . . . . 64.400000000000006 112.366 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 1.2 t 49.61 32.36 4.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.46 . . . . 72.310000000000002 110.877 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -116.31 162.56 25.69 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.598 0.713 . . . . 74.219999999999999 110.872 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.68 -18.19 37.5 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.714 2.276 . . . . 73.109999999999999 112.355 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 65.92 146.15 0.1 OUTLIER Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.593 0.711 . . . . 70.129999999999995 111.08 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.79 153.49 68.72 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.674 2.249 . . . . 63.310000000000002 112.362 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 5.2 mtmp? -100.4 161.17 24.92 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.598 0.713 . . . . 60.299999999999997 110.894 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 165.31 31.38 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.664 2.243 . . . . 63.32 112.356 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 88.01 0.54 Allowed 'Trans proline' 0 C--N 1.341 0.14 0 C-N-CA 122.678 2.252 . . . . 73.450000000000003 112.321 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 1.3 m -113.06 74.15 0.85 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 63.310000000000002 110.838 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 77.8 p -82.66 -175.17 5.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.121 -0.49 . . . . 61.409999999999997 110.828 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.12 -0.491 . . . . 74.120000000000005 111.126 179.901 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.797 0.332 . . . . 75.230000000000004 110.862 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' -1' ' ' ALA . . . . . 0.593 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -136.97 160.44 66.17 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.518 0.675 . . . . 75.239999999999995 111.137 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.593 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.4 Cg_endo -69.82 126.61 13.47 Favored 'Trans proline' 0 C--O 1.231 0.155 0 C-N-CA 122.66 2.24 . . . . 74.530000000000001 112.366 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.631 HD11 HD12 ' A' ' 28' ' ' ILE . 0.5 OUTLIER -118.36 156.28 29.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 72.530000000000001 110.939 -179.983 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -130.15 150.65 51.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 72.450000000000003 110.866 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -135.04 144.86 47.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.154 -0.476 . . . . 41.140000000000001 111.102 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.67 HG23 ' O ' ' A' ' 24' ' ' GLU . 10.0 p -114.58 129.38 70.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 75.109999999999999 111.131 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.652 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -69.17 132.3 46.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.47 . . . . 50.329999999999998 111.119 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.753 HD11 ' HB2' ' A' ' 56' ' ' ARG . 3.8 mt -100.73 -20.94 15.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 74.219999999999999 110.918 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -129.25 168.62 15.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.472 . . . . 71.030000000000001 110.942 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -88.91 104.89 17.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.479 . . . . 73.219999999999999 110.899 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.409 ' HB3' HG12 ' A' ' 20' ' ' VAL . 16.7 t80 -91.46 104.42 16.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 72.040000000000006 110.886 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.6 mmtp -84.96 106.44 16.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 71.120000000000005 110.909 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.24 158.74 3.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.225 -0.443 . . . . 41.020000000000003 111.116 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -128.49 -39.2 1.68 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.23 -0.441 . . . . 62.229999999999997 110.863 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 16.0 mmm180 -108.28 178.86 4.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 74.239999999999995 110.854 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -67.27 -36.38 81.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.193 -0.458 . . . . 63.530000000000001 110.833 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -68.76 -49.14 61.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 73.150000000000006 110.903 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -57.04 135.45 56.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.22 -0.445 . . . . 63.450000000000003 110.88 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 18' ' ' LEU . 11.0 tp -112.13 129.77 56.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 62.329999999999998 110.91 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.01 142.1 45.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 74.299999999999997 110.846 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.783 HG21 HD11 ' A' ' 26' ' ' LEU . 6.4 p -152.82 144.61 15.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.198 -0.456 . . . . 62.219999999999999 111.135 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.3 m -105.47 160.52 25.77 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.668 0.746 . . . . 63.240000000000002 110.89 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 122.23 8.92 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.694 2.263 . . . . 72.439999999999998 112.38 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.09 5.53 30.53 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.765 -0.731 . . . . 70.120000000000005 112.473 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.67 ' O ' HG23 ' A' ' 5' ' ' VAL . 13.8 mt-10 -92.3 161.08 14.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.82 0.343 . . . . 74.430000000000007 110.91 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -107.83 127.03 53.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.195 -0.457 . . . . 75.219999999999999 110.894 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.783 HD11 HG21 ' A' ' 20' ' ' VAL . 2.1 mt -129.7 146.5 51.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 74.420000000000002 110.919 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.7 t -104.86 112.54 25.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 60.140000000000001 110.887 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.798 HG12 ' HB2' ' A' ' 39' ' ' ALA . 58.1 mt -81.92 145.41 8.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.128 -0.487 . . . . 73.099999999999994 111.147 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 80.8 m -117.27 -33.41 4.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 43.140000000000001 110.869 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -161.04 173.57 15.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 41.140000000000001 111.102 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.426 ' ND1' HD13 ' A' ' 81' ' ' ILE . 1.5 p80 -122.84 177.95 5.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 73.209999999999994 110.845 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -141.94 99.95 3.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 74.430000000000007 110.934 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.3 t0 54.61 22.82 4.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.087 -0.506 . . . . 74.450000000000003 110.911 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.625 ' HD2' HD12 ' A' ' 81' ' ' ILE . 37.1 m-85 63.74 15.42 8.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 63.240000000000002 110.925 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -103.46 -40.89 6.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.07 -0.514 . . . . 65.0 110.897 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.418 ' CZ2' ' HB2' ' B' ' -3' ' ' ARG . 91.1 m95 -122.24 164.22 18.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.194 -0.457 . . . . 74.540000000000006 110.902 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.755 ' CD2' HG22 ' A' ' 52' ' ' VAL . 1.3 m-85 -134.63 130.5 36.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 74.310000000000002 110.857 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.562 HG13 HG22 ' A' ' 89' ' ' VAL . 8.5 mm -92.39 94.29 4.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 65.450000000000003 111.146 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.798 ' HB2' HG12 ' A' ' 28' ' ' ILE . . . -124.59 164.49 19.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.191 -0.459 . . . . 71.540000000000006 111.099 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.9 pttm -127.43 157.25 73.42 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.521 0.677 . . . . 64.319999999999993 110.926 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 138.12 37.2 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.683 2.256 . . . . 72.239999999999995 112.32 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 60.5 mt -106.17 -43.25 7.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 73.430000000000007 111.15 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' A ASN . . . . . . . . . . . . . 18.0 t-20 -63.19 -50.7 69.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.205 -0.452 . . . . 64.230000000000004 110.879 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' B ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.25 -177.49 3.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.168 -0.469 . . . . 74.439999999999998 110.893 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 44' ' ' LEU . 9.6 mt -120.88 119.41 32.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.449 . . . . 63.130000000000003 110.898 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -148.78 -52.26 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.751 -0.737 . . . . 33.210000000000001 112.481 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 133.69 167.27 11.56 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.808 -0.71 . . . . 64.109999999999999 112.522 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 116.62 4.65 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.619 2.212 . . . . 63.009999999999998 112.363 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -115.83 -130.71 4.72 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.702 -0.761 . . . . 73.239999999999995 112.487 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -144.18 127.05 16.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.861 0.363 . . . . 71.319999999999993 110.913 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.2 p -135.13 129.85 19.09 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.672 0.749 . . . . 74.349999999999994 111.135 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.68 161.72 44.82 Favored 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.677 2.251 . . . . 65.200000000000003 112.346 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.755 HG22 ' CD2' ' A' ' 37' ' ' PHE . 4.0 t -83.06 -21.74 8.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.238 -0.437 . . . . 71.530000000000001 111.139 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.2 m -75.98 -4.7 42.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.124 -0.489 . . . . 74.25 110.888 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -126.16 -0.82 7.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.128 -0.487 . . . . 65.420000000000002 110.939 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -125.37 147.87 29.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.144 -0.48 . . . . 73.140000000000001 111.133 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.753 ' HB2' HD11 ' A' ' 7' ' ' LEU . 15.7 ttp180 -123.63 110.6 15.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 73.430000000000007 110.814 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.406 ' O ' HG22 ' A' ' 57' ' ' ILE . 1.7 mp -65.76 111.44 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 74.450000000000003 111.146 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.654 HG23 ' HG2' ' A' ' 56' ' ' ARG . 3.5 pt -127.64 141.69 45.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 71.420000000000002 111.107 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -70.43 123.83 22.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 74.329999999999998 110.895 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.0 tp -56.35 -24.93 47.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 74.310000000000002 110.92 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.01 -29.38 16.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 64.349999999999994 110.878 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -143.09 78.49 15.14 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.618 0.723 . . . . 75.340000000000003 110.841 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.748 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.9 Cg_endo -69.76 -7.36 20.85 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.668 2.245 . . . . 73.310000000000002 112.339 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.11 -7.58 38.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.435 . . . . 74.5 111.047 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -84.4 -52.22 6.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.3 -0.409 . . . . 73.310000000000002 110.863 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.648 ' O ' HG12 ' A' ' 69' ' ' VAL . 12.9 m-85 -97.48 23.88 7.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 73.049999999999997 110.914 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.748 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -85.41 -19.2 31.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 74.040000000000006 111.118 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 90.4 p -92.58 -24.13 18.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.237 -0.438 . . . . 65.420000000000002 110.859 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 1.054 HG21 HD11 ' A' ' 80' ' ' ILE . 9.0 p -52.07 155.56 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.477 . . . . 74.0 111.14 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -110.61 94.98 5.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.195 -0.457 . . . . 75.030000000000001 110.871 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.742 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -58.44 -38.64 77.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.175 -0.466 . . . . 61.200000000000003 111.119 -179.867 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -55.1 -44.26 74.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.252 -0.431 . . . . 75.129999999999995 110.917 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -63.74 110.04 1.91 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.134 -0.485 . . . . 52.520000000000003 110.88 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.57 -28.69 21.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 62.530000000000001 110.878 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -66.97 -56.74 8.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 72.140000000000001 110.892 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -58.64 -55.15 38.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 74.109999999999999 110.89 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.55 ' HA ' HD12 ' A' ' 80' ' ' ILE . 5.5 p -53.92 -33.22 23.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 75.230000000000004 111.09 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 14.5 mtm -67.14 -53.5 30.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.231 -0.44 . . . . 72.230000000000004 110.834 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.1 mttm -56.18 -37.4 69.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 55.520000000000003 110.925 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 1.054 HD11 HG21 ' A' ' 69' ' ' VAL . 17.3 mt -66.77 -52.62 43.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 74.299999999999997 111.102 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.744 HG23 ' HB ' ' A' ' 86' ' ' ILE . 90.6 mt -63.25 -33.86 63.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 62.219999999999999 111.096 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -71.11 -46.2 62.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 71.0 110.885 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -68.53 -48.43 64.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.465 . . . . 63.009999999999998 110.844 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -68.75 -15.35 63.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.134 -0.485 . . . . 73.150000000000006 110.839 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt 59.95 49.56 7.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.147 -0.479 . . . . 52.140000000000001 110.884 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.744 ' HB ' HG23 ' A' ' 81' ' ' ILE . 24.5 mt -78.23 131.53 68.94 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.598 0.714 . . . . 71.540000000000006 111.177 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 164.32 34.97 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.701 2.268 . . . . 72.349999999999994 112.307 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -95.41 170.2 9.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.2 -0.455 . . . . 75.530000000000001 111.19 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.562 HG22 HG13 ' A' ' 38' ' ' ILE . 68.6 t -55.81 -54.65 24.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.272 -0.422 . . . . 63.049999999999997 111.122 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -51.95 -50.58 60.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 60.130000000000003 110.893 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -57.74 -44.39 86.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.489 . . . . 73.219999999999999 110.894 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 23.0 t90 -61.68 -43.0 99.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.208 -0.451 . . . . 73.209999999999994 110.921 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 5.1 mmpt? -60.65 -53.25 59.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 65.219999999999999 110.884 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -59.98 -37.82 80.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 74.349999999999994 110.904 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -61.06 -53.03 62.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.481 . . . . 73.209999999999994 110.904 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -61.85 -43.24 99.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 53.119999999999997 111.15 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 13.5 mtt180 -59.74 -60.96 3.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.45 . . . . 73.239999999999995 110.874 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 52.9 mtp180 -55.91 -36.92 68.22 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 74.230000000000004 110.856 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -61.4 -47.41 85.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.44 . . . . 71.140000000000001 110.9 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 8.4 mmmt -74.92 -25.07 58.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.155 -0.475 . . . . 62.5 110.9 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.74 167.83 2.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 61.32 110.897 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.0 p -91.72 169.06 11.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 74.310000000000002 110.868 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 15.1 m -85.02 -167.89 2.0 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 41.530000000000001 110.881 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.507 HG22 ' CD ' ' A' ' 105' ' ' GLN . 7.3 mt -83.92 160.23 3.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.469 . . . . 72.219999999999999 111.127 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.507 ' CD ' HG22 ' A' ' 104' ' ' ILE . 8.8 pm0 -49.22 165.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.452 . . . . 73.409999999999997 110.917 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 21.9 mm -115.56 -24.78 3.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.239 -0.437 . . . . 74.019999999999996 111.134 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -101.29 -140.27 11.15 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.772 -0.728 . . . . 72.140000000000001 112.487 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -112.84 117.55 32.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.923 0.392 . . . . 55.450000000000003 110.894 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -82.0 143.59 23.25 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.709 -0.758 . . . . 75.450000000000003 112.457 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 10.2 m-70 -78.78 177.74 8.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.877 0.37 . . . . 74.200000000000003 110.832 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -80.86 137.93 18.68 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.751 -0.738 . . . . 71.299999999999997 112.484 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -131.33 179.01 6.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.774 0.321 . . . . 54.340000000000003 110.902 -179.879 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 2.1 p -150.25 153.86 36.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 45.329999999999998 110.86 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -133.1 173.26 11.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.157 -0.474 . . . . 60.439999999999998 110.913 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -85.45 90.73 1.66 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.748 -0.739 . . . . 25.43 112.508 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 19.5 mt -124.51 -73.9 0.63 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.814 0.34 . . . . 74.109999999999999 110.875 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 50.399999999999999 110.823 180.0 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 N-CA-C 112.521 -0.232 . . . . 51.210000000000001 112.521 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.08 -38.88 2.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.811 0.339 . . . . 71.239999999999995 110.871 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -74.38 -74.73 0.18 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.216 -0.447 . . . . 71.299999999999997 110.948 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 26.8 mm 53.06 76.31 0.54 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.653 0.739 . . . . 65.140000000000001 111.163 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.67 78.42 0.98 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.704 2.269 . . . . 63.32 112.386 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 14.5 t -81.13 -0.52 40.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 54.310000000000002 110.824 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' -3' ' ' ARG . . . . . 0.418 ' HB2' ' CZ2' ' A' ' 36' ' ' TRP . 24.5 mmt180 -48.91 161.21 0.43 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.575 0.702 . . . . 74.230000000000004 110.874 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 -26.21 27.62 Favored 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.677 2.251 . . . . 64.109999999999999 112.344 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.29 85.84 0.15 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.591 0.71 . . . . 72.349999999999994 111.08 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 158.38 57.09 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.622 2.215 . . . . 75.530000000000001 112.367 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.94 160.45 33.79 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.582 0.706 . . . . 75.120000000000005 110.894 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 167.48 24.34 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.674 2.25 . . . . 74.519999999999996 112.345 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 119.87 6.75 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.645 2.23 . . . . 62.109999999999999 112.37 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 17.3 m -62.8 162.65 10.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 53.420000000000002 110.871 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 7.8 t -127.59 -45.62 1.47 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.153 -0.476 . . . . 75.439999999999998 110.865 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 71.099999999999994 111.094 179.909 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 21.3 ptm . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.783 0.325 . . . . 74.030000000000001 110.864 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' -1' ' ' ALA . . . . . 0.564 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -149.22 159.84 36.07 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.657 0.741 . . . . 54.030000000000001 111.072 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.564 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.9 Cg_endo -69.79 78.42 1.02 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.694 2.263 . . . . 74.030000000000001 112.332 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.697 HD11 HG13 ' A' ' 28' ' ' ILE . 0.4 OUTLIER -90.98 145.45 24.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 74.0 110.937 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -123.26 142.84 50.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.466 . . . . 70.329999999999998 110.875 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -122.76 150.49 42.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 70.420000000000002 111.057 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.1 p -116.07 129.08 73.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.176 -0.465 . . . . 65.200000000000003 111.127 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.707 HG21 ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -68.39 132.46 47.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.453 . . . . 63.439999999999998 111.153 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.779 HD11 ' HB2' ' A' ' 56' ' ' ARG . 7.1 mt -102.71 -16.81 15.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.208 -0.451 . . . . 64.420000000000002 110.909 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -136.49 161.99 34.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.474 . . . . 64.450000000000003 110.924 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -86.87 114.26 23.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.086 -0.506 . . . . 61.520000000000003 110.865 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -100.2 130.08 46.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.115 -0.493 . . . . 73.230000000000004 110.88 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -104.21 109.36 21.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.12 -0.491 . . . . 65.109999999999999 110.913 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.478 ' HB1' ' HB3' ' A' ' 17' ' ' GLU . . . -62.86 159.58 16.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 71.310000000000002 111.114 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -116.57 -28.44 6.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 74.239999999999995 110.89 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -141.46 -174.52 4.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 74.299999999999997 110.846 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -64.71 -39.19 93.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.172 -0.467 . . . . 73.430000000000007 110.824 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -62.86 -18.4 62.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.222 -0.445 . . . . 71.209999999999994 110.85 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.478 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 0.4 OUTLIER -110.2 140.12 44.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 73.329999999999998 110.912 -179.904 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.434 ' C ' ' HB2' ' A' ' 12' ' ' ALA . 4.6 tp -114.57 153.77 29.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 74.439999999999998 110.898 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -97.78 126.77 43.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.476 . . . . 62.340000000000003 110.864 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.707 ' HB ' HG21 ' A' ' 6' ' ' THR . 0.2 OUTLIER -125.51 159.29 33.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.246 -0.433 . . . . 72.209999999999994 111.16 179.955 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.4 m -124.27 159.25 58.01 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.654 0.74 . . . . 45.439999999999998 110.799 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 118.48 5.71 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.656 2.238 . . . . 73.219999999999999 112.329 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.02 -0.34 31.6 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.758 -0.734 . . . . 63.25 112.504 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -89.25 151.37 22.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.863 0.363 . . . . 74.439999999999998 110.888 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.568 ' CB ' HD12 ' A' ' 42' ' ' ILE . 10.5 m120 -96.61 112.63 24.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.136 -0.483 . . . . 65.430000000000007 110.881 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.754 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 3.1 mm? -112.25 142.04 45.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.193 -0.458 . . . . 64.209999999999994 110.905 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.72 112.48 24.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 60.439999999999998 110.85 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.697 HG13 HD11 ' A' ' 2' ' ' LEU . 31.3 mm -66.94 144.89 14.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 71.420000000000002 111.117 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.5 m -122.46 -42.09 2.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.169 -0.469 . . . . 62.140000000000001 110.904 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.409 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -171.77 168.97 6.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 62.539999999999999 111.117 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.442 ' CE1' HG21 ' A' ' 81' ' ' ILE . 2.1 p80 -119.45 178.31 4.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 65.430000000000007 110.861 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -148.69 105.7 3.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 65.140000000000001 110.854 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 56.54 22.52 6.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.084 -0.507 . . . . 74.310000000000002 110.866 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.614 ' HD2' HD12 ' A' ' 81' ' ' ILE . 16.5 m-85 57.78 22.78 8.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 72.540000000000006 110.939 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -121.06 -5.47 9.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.119 -0.491 . . . . 70.230000000000004 110.935 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.555 ' HB3' HD11 ' A' ' 49' ' ' LEU . 98.7 m95 -152.51 158.8 43.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.11 -0.495 . . . . 74.109999999999999 110.89 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.601 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.5 OUTLIER -141.55 151.67 43.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.458 . . . . 71.120000000000005 110.888 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.42 ' CD1' HD22 ' A' ' 49' ' ' LEU . 6.3 mm -109.49 94.03 2.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.191 -0.459 . . . . 71.120000000000005 111.121 179.977 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.754 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -107.25 146.03 31.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 75.239999999999995 111.159 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -118.0 155.56 51.07 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.584 0.706 . . . . 64.519999999999996 110.93 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 123.7 10.35 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.66 2.24 . . . . 73.219999999999999 112.329 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.568 HD12 ' CB ' ' A' ' 25' ' ' ASN . 69.5 mt -78.04 -46.23 26.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 70.239999999999995 111.123 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' A ASN . . . . . . . . . . . . . 15.7 m120 -60.72 -70.49 0.17 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.15 -0.477 . . . . 64.019999999999996 110.914 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' B ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.04 -173.53 3.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 72.230000000000004 110.863 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.43 -74.75 0.65 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.191 -0.459 . . . . 64.150000000000006 110.903 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 57.85 -97.92 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.697 -0.763 . . . . 64.200000000000003 112.484 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 177.49 164.06 30.4 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.758 -0.734 . . . . 54.229999999999997 112.491 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 140.92 43.89 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.692 2.262 . . . . 54.009999999999998 112.365 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -129.71 -146.44 6.04 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.739 -0.743 . . . . 53.219999999999999 112.477 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.555 HD11 ' HB3' ' A' ' 36' ' ' TRP . 0.1 OUTLIER -137.04 124.75 22.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.828 0.347 . . . . 64.129999999999995 110.889 -179.932 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.424 ' N ' HD13 ' A' ' 49' ' ' LEU . 14.5 p -134.26 132.25 21.0 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.636 0.731 . . . . 71.329999999999998 111.109 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.665 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.6 Cg_endo -69.8 158.36 57.19 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.677 2.251 . . . . 53.5 112.328 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.922 HG11 HG21 ' A' ' 77' ' ' VAL . 2.7 t -76.3 -20.86 15.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 75.409999999999997 111.128 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.4 m -79.71 0.95 28.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 73.439999999999998 110.856 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.407 ' HB2' ' HG2' ' A' ' 51' ' ' PRO . 7.5 m-85 -118.75 -27.13 5.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.145 -0.48 . . . . 75.409999999999997 110.959 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.665 HG22 ' O ' ' A' ' 51' ' ' PRO . 13.1 m -106.23 147.9 11.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.081 -0.508 . . . . 43.439999999999998 111.123 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.779 ' HB2' HD11 ' A' ' 7' ' ' LEU . 15.4 ttp180 -117.66 110.9 18.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 55.200000000000003 110.874 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.42 ' O ' HG22 ' A' ' 57' ' ' ILE . 1.6 mp -68.76 112.39 3.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 53.399999999999999 111.125 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.66 HG23 ' HG2' ' A' ' 56' ' ' ARG . 7.1 pt -125.22 167.16 19.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.455 . . . . 74.25 111.171 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -102.42 125.39 49.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 62.210000000000001 110.895 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.3 mt -56.22 -24.7 43.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 63.240000000000002 110.951 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.75 -29.92 18.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.15 -0.477 . . . . 73.140000000000001 110.856 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -145.92 74.74 13.27 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.596 0.712 . . . . 63.439999999999998 110.898 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.669 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.4 Cg_endo -69.76 -8.83 24.61 Favored 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.711 2.274 . . . . 73.409999999999997 112.359 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.96 -5.9 36.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 54.43 111.078 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.2 ttmm -84.1 -51.97 6.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 73.340000000000003 110.884 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -90.67 -0.08 57.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.444 . . . . 75.519999999999996 110.895 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.669 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -61.3 -17.86 55.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 62.030000000000001 111.12 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 86.2 p -76.62 -24.16 53.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.25 -0.432 . . . . 52.530000000000001 110.817 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.7 HG12 ' H ' ' A' ' 71' ' ' THR . 14.2 t -77.77 121.76 31.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 74.239999999999995 111.11 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -90.25 11.68 20.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 65.349999999999994 110.835 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.858 ' HB ' HG12 ' A' ' 52' ' ' VAL . 2.0 p 45.91 33.7 1.69 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.471 . . . . 75.519999999999996 111.163 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -104.12 -54.83 2.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 73.049999999999997 110.951 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.86 115.44 4.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 75.019999999999996 110.812 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.04 -28.99 19.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.457 . . . . 73.030000000000001 110.896 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -66.61 -49.04 67.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 74.0 110.909 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -62.95 -57.0 12.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 74.510000000000005 110.961 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.922 HG21 HG11 ' A' ' 52' ' ' VAL . 1.7 p -54.31 -31.7 22.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 63.140000000000001 111.162 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 11.5 mtm -67.91 -54.11 21.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.492 . . . . 63.439999999999998 110.844 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 34.8 mttt -57.55 -35.79 70.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 73.349999999999994 110.901 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.516 HD11 HG11 ' A' ' 69' ' ' VAL . 41.8 mt -67.71 -50.47 60.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 71.140000000000001 111.118 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.725 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.4 mt -65.64 -35.7 75.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 65.409999999999997 111.084 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -71.21 -52.05 21.24 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 72.299999999999997 110.886 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -58.57 -52.69 64.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.185 -0.461 . . . . 73.319999999999993 110.923 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -67.95 -15.51 63.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 72.099999999999994 110.885 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.8 mmtm 60.94 54.98 3.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.486 . . . . 53.420000000000002 110.942 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.725 ' HB ' HG23 ' A' ' 81' ' ' ILE . 21.2 mt -82.25 131.3 56.52 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.622 0.725 . . . . 63.109999999999999 111.129 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.409 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 54.5 Cg_endo -69.72 162.81 40.59 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.654 2.236 . . . . 73.230000000000004 112.346 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.19 171.48 7.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.196 -0.456 . . . . 64.040000000000006 111.13 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 85.8 t -51.94 -53.98 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 61.409999999999997 111.148 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 69.2 mt-10 -51.68 -51.99 51.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 73.519999999999996 110.853 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 60.4 mm-40 -59.21 -43.88 92.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.446 . . . . 44.420000000000002 110.939 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 32.9 t90 -62.61 -38.75 91.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 71.510000000000005 110.893 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 5.8 mmpt? -64.95 -52.8 54.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 63.32 110.867 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.23 -41.92 85.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.234 -0.439 . . . . 71.310000000000002 110.879 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -63.09 -46.44 87.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.225 -0.443 . . . . 65.450000000000003 110.947 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.1 p -64.58 -33.41 75.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.451 . . . . 71.310000000000002 111.152 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -69.99 -63.95 0.98 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 74.120000000000005 110.877 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.77 -38.99 65.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 75.239999999999995 110.9 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -65.66 -52.87 48.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.194 -0.457 . . . . 62.210000000000001 110.908 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.46 -25.3 65.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 44.439999999999998 110.93 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -86.33 179.29 6.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.194 -0.457 . . . . 75.310000000000002 110.903 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.2 m -96.24 179.16 5.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 74.040000000000006 110.856 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.6 m -115.37 -170.56 1.79 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.105 -0.498 . . . . 72.0 110.845 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 27.7 mm -69.97 150.61 10.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.137 -0.483 . . . . 72.340000000000003 111.099 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -173.82 -176.43 1.22 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 74.439999999999998 110.901 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 28.7 mm -96.8 98.18 7.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.457 . . . . 64.409999999999997 111.155 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 171.77 121.67 0.61 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.752 -0.737 . . . . 22.350000000000001 112.457 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -52.1 134.8 32.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.853 0.358 . . . . 61.140000000000001 110.902 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 169.99 44.03 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.693 -0.765 . . . . 75.439999999999998 112.493 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 31.7 t-80 -144.89 163.66 33.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.841 0.353 . . . . 53.310000000000002 110.887 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -145.9 -159.99 8.45 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.772 -0.728 . . . . 53.109999999999999 112.498 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -157.69 145.0 18.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.776 0.322 . . . . 73.120000000000005 110.946 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.7 p -72.34 179.83 3.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 73.030000000000001 110.833 -179.744 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -74.42 -56.95 4.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 72.299999999999997 110.93 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 107.3 92.11 2.24 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.718 -0.753 . . . . 75.140000000000001 112.514 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -110.85 61.08 0.61 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.766 0.317 . . . . 53.149999999999999 110.921 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 71.310000000000002 110.871 179.94 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' -9' ' ' GLY . . . . . 0.52 ' CA ' HD11 ' B' ' -6' ' ' ILE . . . . . . . . 0 N--CA 1.451 -0.314 0 N-CA-C 112.498 -0.241 . . . . 74.329999999999998 112.498 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 14.4 ttpp -95.09 -65.97 0.94 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.753 0.311 . . . . 55.420000000000002 110.91 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -54.64 -74.72 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.454 . . . . 64.310000000000002 110.857 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' -6' ' ' ILE . . . . . 0.52 HD11 ' CA ' ' B' ' -9' ' ' GLY . 22.0 mm 56.48 77.88 0.4 Allowed Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.663 0.744 . . . . 63.229999999999997 111.16 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.82 86.9 0.57 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.635 2.223 . . . . 73.25 112.365 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 13.2 t -80.4 -1.39 41.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.456 . . . . 75.530000000000001 110.862 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' -3' ' ' ARG . . . . . 0.406 ' HB2' ' CZ2' ' A' ' 36' ' ' TRP . 0.0 OUTLIER -49.92 163.2 0.43 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.628 0.727 . . . . 74.25 110.85 -179.96 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 -22.64 31.87 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.686 2.258 . . . . 74.340000000000003 112.385 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.63 84.07 0.19 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.577 0.703 . . . . 74.200000000000003 111.135 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 163.24 38.97 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.721 2.28 . . . . 74.310000000000002 112.368 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -100.14 160.47 27.02 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.601 0.715 . . . . 62.229999999999997 110.879 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 163.84 36.77 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.691 2.261 . . . . 51.409999999999997 112.339 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -32.18 19.06 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.702 2.268 . . . . 61.130000000000003 112.319 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 1.3 m 56.67 27.39 12.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 75.230000000000004 110.862 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 13.1 t -108.94 134.08 52.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.111 -0.495 . . . . 72.239999999999995 110.872 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 70.219999999999999 111.095 179.902 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 4.0 ppp? . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.764 0.316 . . . . 64.430000000000007 110.914 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' -1' ' ' ALA . . . . . 0.587 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -136.78 160.38 66.62 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.553 0.692 . . . . 60.130000000000003 111.124 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.587 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 54.0 Cg_endo -69.73 83.53 0.69 Allowed 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.683 2.255 . . . . 52.420000000000002 112.367 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -80.85 147.71 30.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 74.030000000000001 110.913 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.724 ' CE1' HD12 ' A' ' 60' ' ' LEU . 12.7 m-85 -116.8 163.9 15.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.469 . . . . 65.099999999999994 110.93 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -142.91 164.02 31.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 72.219999999999999 111.099 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 24' ' ' GLU . 10.9 p -130.71 130.89 64.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 61.020000000000003 111.143 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.606 HG21 ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -72.86 139.6 47.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 74.439999999999998 111.09 -179.931 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.683 HD11 ' HB2' ' A' ' 56' ' ' ARG . 23.3 mt -114.07 -11.22 12.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 64.319999999999993 110.915 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -137.01 159.63 41.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 71.310000000000002 110.892 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -85.74 108.85 18.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 75.530000000000001 110.871 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -93.63 139.28 30.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 75.25 110.855 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -112.97 97.1 6.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.118 -0.492 . . . . 54.43 110.927 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.67 157.36 1.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.451 . . . . 72.120000000000005 111.108 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -115.82 -32.97 5.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 70.400000000000006 110.894 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -133.11 -178.45 4.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 72.319999999999993 110.886 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -63.47 -41.34 98.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.207 -0.451 . . . . 71.109999999999999 110.832 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -57.32 -23.68 50.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.211 -0.45 . . . . 63.030000000000001 110.901 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.0 152.23 19.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 55.130000000000003 110.908 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.676 HD13 ' O ' ' A' ' 46' ' ' GLY . 1.2 tt -131.77 120.55 22.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.138 -0.483 . . . . 64.340000000000003 110.945 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -63.73 143.62 57.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.235 -0.439 . . . . 74.540000000000006 110.836 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.606 ' HB ' HG21 ' A' ' 6' ' ' THR . 0.9 OUTLIER -139.95 159.11 26.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 72.329999999999998 111.144 -179.984 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.3 m -121.44 158.07 54.57 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.671 0.748 . . . . 73.209999999999994 110.861 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.72 117.96 5.39 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.709 2.273 . . . . 74.329999999999998 112.375 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.06 4.66 31.14 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.737 -0.744 . . . . 55.039999999999999 112.448 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.531 ' O ' HG23 ' A' ' 5' ' ' VAL . 39.5 mm-40 -92.12 154.59 18.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.85 0.357 . . . . 74.439999999999998 110.869 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -105.61 115.82 30.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 63.340000000000003 110.92 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.731 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 3.7 mp -116.55 155.35 28.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.201 -0.454 . . . . 62.450000000000003 110.938 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.5 t -108.26 112.79 25.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 73.040000000000006 110.895 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 57.4 mt -75.72 144.86 11.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 64.0 111.146 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.8 m -116.23 -43.94 2.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.144 -0.48 . . . . 72.409999999999997 110.924 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.52 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -161.02 174.8 13.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 54.310000000000002 111.115 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.439 ' CE1' HG21 ' A' ' 81' ' ' ILE . 3.3 p80 -121.18 177.95 4.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 75.519999999999996 110.829 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.431 ' HB3' ' HB2' ' A' ' 36' ' ' TRP . 20.2 t80 -146.87 100.83 3.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.206 -0.452 . . . . 71.420000000000002 110.91 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.416 ' HB3' ' HG2' ' A' ' 35' ' ' GLU . 33.6 t0 59.97 17.5 6.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.098 -0.501 . . . . 64.219999999999999 110.905 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.575 ' HD2' HD12 ' A' ' 81' ' ' ILE . 41.3 m-85 63.47 29.65 15.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.169 -0.469 . . . . 72.299999999999997 110.939 -179.809 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.416 ' HG2' ' HB3' ' A' ' 33' ' ' ASP . 4.4 pt-20 -131.16 -1.76 4.02 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.101 -0.499 . . . . 64.540000000000006 110.921 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.448 ' HB3' HD21 ' A' ' 49' ' ' LEU . 88.1 m95 -152.73 135.52 15.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.107 -0.497 . . . . 74.140000000000001 110.905 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.581 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.5 OUTLIER -121.78 131.38 54.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.259 -0.428 . . . . 75.120000000000005 110.871 -179.951 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.4 mm -87.04 94.55 4.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 71.349999999999994 111.154 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.731 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -111.1 138.99 46.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 74.430000000000007 111.106 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 51.2 pttt -112.82 153.67 45.07 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.55 0.69 . . . . 72.319999999999993 110.903 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 119.56 6.49 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.664 2.243 . . . . 65.299999999999997 112.394 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.4 mt -78.07 -19.54 13.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 72.239999999999995 111.16 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' A ASN . . . . . . . . . . . . . 7.0 t30 -68.26 -55.83 10.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 65.219999999999999 110.936 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' B ARG . . . . . . . . . . . . . 8.0 ptm180 -83.6 -171.3 3.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 75.310000000000002 110.832 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 12.0 mt -51.68 -75.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 73.109999999999999 110.928 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 177.53 91.3 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.768 -0.729 . . . . 25.300000000000001 112.492 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.676 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -111.62 80.55 0.27 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.71 -0.757 . . . . 64.200000000000003 112.485 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.74 105.22 1.44 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.697 2.265 . . . . 73.439999999999998 112.348 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -105.6 -106.47 3.12 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.752 -0.737 . . . . 72.510000000000005 112.455 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.448 HD21 ' HB3' ' A' ' 36' ' ' TRP . 1.3 tt -163.55 124.73 2.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.837 0.351 . . . . 72.25 110.935 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.453 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.3 p -137.56 133.8 18.15 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.658 0.742 . . . . 72.230000000000004 111.074 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.453 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.9 Cg_endo -69.78 153.85 68.36 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.661 2.241 . . . . 75.019999999999996 112.355 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.822 HG12 ' HB ' ' A' ' 71' ' ' THR . 4.9 t -72.59 -21.01 19.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 64.319999999999993 111.148 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.0 m -77.0 -2.58 34.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 71.109999999999999 110.837 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.441 ' O ' HG22 ' A' ' 6' ' ' THR . 37.7 m-85 -127.22 22.8 6.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.107 -0.497 . . . . 64.299999999999997 110.881 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.616 HG22 ' HA ' ' A' ' 52' ' ' VAL . 10.7 m -148.63 163.23 5.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.119 -0.491 . . . . 72.219999999999999 111.155 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.686 ' HG2' HG23 ' A' ' 58' ' ' ILE . 26.1 ttm180 -130.57 119.09 21.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.461 . . . . 73.430000000000007 110.883 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 43.2 mm -70.13 108.8 2.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.456 . . . . 72.540000000000006 111.152 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.686 HG23 ' HG2' ' A' ' 56' ' ' ARG . 1.4 pt -134.18 132.82 55.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 73.120000000000005 111.15 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -67.34 145.77 54.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 63.32 110.868 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.724 HD12 ' CE1' ' A' ' 3' ' ' PHE . 0.4 OUTLIER -71.31 -36.67 71.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 73.120000000000005 110.911 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.24 -24.49 32.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 74.310000000000002 110.898 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -148.76 74.17 10.34 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.607 0.717 . . . . 62.109999999999999 110.904 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.677 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.7 Cg_endo -69.74 -8.57 23.95 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.688 2.259 . . . . 62.43 112.331 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.46 -18.46 23.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 72.549999999999997 111.113 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.8 ttmt -74.62 -50.32 18.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 73.120000000000005 110.921 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.536 ' O ' HG12 ' A' ' 69' ' ' VAL . 65.5 m-85 -95.25 23.27 5.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 75.310000000000002 110.939 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.677 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -89.48 11.71 18.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.13 -0.486 . . . . 53.530000000000001 111.11 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.7 p -114.87 -24.04 8.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 72.519999999999996 110.869 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.536 HG12 ' O ' ' A' ' 66' ' ' TYR . 7.9 p -55.18 140.24 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.145 -0.48 . . . . 54.009999999999998 111.134 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.4 m-20 -99.44 93.72 6.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 72.430000000000007 110.887 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.822 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -50.84 -30.15 13.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 70.409999999999997 111.127 -179.884 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -57.38 -51.02 71.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 72.420000000000002 110.876 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -63.99 110.11 2.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.172 -0.467 . . . . 70.319999999999993 110.824 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -24.29 39.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 74.450000000000003 110.865 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -66.87 -52.96 37.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 74.319999999999993 110.858 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.602 ' O ' HD12 ' A' ' 80' ' ' ILE . 1.2 mt-30 -60.15 -58.45 8.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 75.010000000000005 110.943 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.519 HG21 HG11 ' A' ' 52' ' ' VAL . 2.6 p -51.63 -32.27 13.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 73.349999999999994 111.162 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.8 mtm -68.16 -51.73 42.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 70.040000000000006 110.93 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.1 mttm -55.39 -47.07 76.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.209 -0.451 . . . . 74.219999999999999 110.94 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.602 HD12 ' O ' ' A' ' 76' ' ' GLN . 1.7 mp -60.98 -53.73 45.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 71.319999999999993 111.153 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.575 HD12 ' HD2' ' A' ' 34' ' ' TYR . 82.0 mt -57.35 -36.05 51.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.154 -0.476 . . . . 51.539999999999999 111.138 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -71.16 -51.9 22.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 75.510000000000005 110.883 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -59.14 -49.4 78.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.445 . . . . 74.329999999999998 110.924 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -67.9 -15.88 63.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 75.549999999999997 110.868 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 29.6 mmtm 61.31 49.51 5.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 75.430000000000007 110.873 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.565 ' HB ' HG23 ' A' ' 81' ' ' ILE . 38.2 mt -79.14 125.16 84.04 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.598 0.714 . . . . 61.229999999999997 111.158 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.52 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 54.0 Cg_endo -69.68 168.72 20.63 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.699 2.266 . . . . 63.399999999999999 112.342 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.77 167.04 14.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 42.450000000000003 111.125 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.689 HG12 ' CE ' ' A' ' 93' ' ' LYS . 96.2 t -51.04 -58.88 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.205 -0.452 . . . . 74.430000000000007 111.139 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -51.28 -48.04 62.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.481 . . . . 73.049999999999997 110.877 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -56.8 -33.48 66.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.465 . . . . 75.420000000000002 110.886 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 22.3 t90 -66.78 -41.01 88.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.241 -0.436 . . . . 75.010000000000005 110.888 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.689 ' CE ' HG12 ' A' ' 89' ' ' VAL . 16.7 mtmt -67.4 -49.32 64.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 73.239999999999995 110.915 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -61.6 -39.7 92.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 55.140000000000001 110.836 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -65.27 -48.84 71.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 72.510000000000005 110.937 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 3.6 p -63.19 -33.78 76.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 75.010000000000005 111.141 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 10.2 mtm180 -68.18 -58.28 4.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.216 -0.447 . . . . 75.140000000000001 110.886 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.17 -25.15 68.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 70.420000000000002 110.903 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -83.29 -30.15 27.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 74.439999999999998 110.945 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 16.1 mtpt -83.63 -17.14 42.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.112 -0.494 . . . . 65.519999999999996 110.946 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -51.34 165.98 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 44.149999999999999 110.856 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.5 p -76.9 92.07 3.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.115 -0.493 . . . . 60.439999999999998 110.877 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 39.1 m -149.15 -171.81 3.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 62.409999999999997 110.883 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 30.0 mm -64.49 138.22 23.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.167 -0.47 . . . . 75.5 111.132 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -178.14 171.85 1.65 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.137 -0.483 . . . . 72.510000000000005 110.927 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.511 ' H ' HD13 ' A' ' 106' ' ' ILE . 0.1 OUTLIER -142.41 174.33 5.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 65.420000000000002 111.117 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 107.16 84.25 1.67 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.726 -0.75 . . . . 74.430000000000007 112.47 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -73.24 123.7 24.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.917 0.389 . . . . 64.5 110.905 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 165.96 98.03 0.12 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.766 -0.731 . . . . 74.030000000000001 112.497 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -125.73 162.52 24.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.848 0.356 . . . . 65.430000000000007 110.866 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -167.14 179.0 41.08 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.729 -0.748 . . . . 72.140000000000001 112.541 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -151.59 166.01 32.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.85 0.357 . . . . 73.450000000000003 110.88 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.1 p -155.05 144.23 21.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 64.329999999999998 110.855 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.63 138.63 55.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 73.120000000000005 110.9 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -129.58 91.37 0.31 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.694 -0.765 . . . . 72.510000000000005 112.453 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -127.86 -39.16 1.8 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.795 0.331 . . . . 54.450000000000003 110.915 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.201 -0.454 . . . . 64.209999999999994 110.887 179.925 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.496 -0.241 . . . . 72.239999999999995 112.496 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 32.6 mtpt -95.06 -38.78 10.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.8 0.334 . . . . 64.420000000000002 110.941 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -88.93 -76.36 0.41 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 65.120000000000005 110.898 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 28.8 mm 50.1 78.18 0.42 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.612 0.72 . . . . 70.310000000000002 111.149 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 88.75 0.53 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.689 2.259 . . . . 72.239999999999995 112.356 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 36.8 p -78.6 -2.8 40.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 55.229999999999997 110.839 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' -3' ' ' ARG . . . . . 0.445 ' HB2' ' CZ2' ' A' ' 36' ' ' TRP . 22.3 mmm-85 -49.92 160.53 0.63 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.616 0.722 . . . . 75.540000000000006 110.853 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 -19.27 36.61 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.673 2.249 . . . . 54.43 112.337 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.54 84.29 0.18 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.596 0.712 . . . . 72.010000000000005 111.135 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.66 160.06 51.14 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.717 2.278 . . . . 73.510000000000005 112.365 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.75 160.47 27.8 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.543 0.687 . . . . 54.130000000000003 110.884 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 167.28 24.91 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.658 2.238 . . . . 72.420000000000002 112.338 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.81 -177.62 1.98 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.705 2.27 . . . . 62.310000000000002 112.313 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 27.0 t -171.68 133.62 0.78 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 60.049999999999997 110.842 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 11.7 m -125.36 135.09 52.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 74.140000000000001 110.863 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 63.549999999999997 111.056 179.946 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.781 0.324 . . . . 65.439999999999998 110.898 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' -1' ' ' ALA . . . . . 0.61 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -51.99 160.82 1.07 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.599 0.714 . . . . 64.510000000000005 111.108 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.61 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.7 Cg_endo -69.76 128.8 16.55 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.677 2.251 . . . . 73.129999999999995 112.33 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.642 HD12 ' HB ' ' A' ' 28' ' ' ILE . 0.1 OUTLIER -112.25 125.01 53.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.153 -0.476 . . . . 72.430000000000007 110.899 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.462 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 73.9 m-85 -140.89 139.8 34.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 75.219999999999999 110.889 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.698 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -128.22 159.61 34.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.113 -0.494 . . . . 64.340000000000003 111.094 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 24' ' ' GLU . 6.1 p -127.75 120.9 55.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.259 -0.428 . . . . 73.319999999999993 111.166 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.702 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -62.98 128.48 36.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 71.200000000000003 111.143 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.501 HD11 ' HB2' ' A' ' 56' ' ' ARG . 33.9 mt -101.57 -15.54 17.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.225 -0.443 . . . . 64.519999999999996 110.927 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -137.51 157.68 46.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 75.540000000000006 110.948 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -80.08 105.09 11.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.099 -0.5 . . . . 72.400000000000006 110.925 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -93.55 101.08 13.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 61.340000000000003 110.887 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.34 121.54 25.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.474 . . . . 75.5 110.915 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.59 146.84 52.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 71.319999999999993 111.095 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -116.34 -26.63 7.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.238 -0.437 . . . . 75.219999999999999 110.853 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -124.36 178.53 5.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 74.409999999999997 110.862 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -68.8 -26.71 65.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.192 -0.458 . . . . 71.010000000000005 110.849 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -77.36 -31.56 54.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 73.439999999999998 110.898 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -74.36 148.49 41.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 72.420000000000002 110.907 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.489 HD22 ' O ' ' A' ' 46' ' ' GLY . 5.7 tp -122.31 134.79 54.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.191 -0.459 . . . . 65.140000000000001 110.906 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -80.41 132.44 35.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.444 . . . . 75.340000000000003 110.852 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.702 ' CG1' HG21 ' A' ' 6' ' ' THR . 9.7 p -146.38 147.05 18.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 71.530000000000001 111.115 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.3 m -107.83 160.27 27.42 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.667 0.746 . . . . 73.200000000000003 110.849 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 125.91 12.68 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.7 2.266 . . . . 74.340000000000003 112.315 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.05 1.5 31.7 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.777 -0.725 . . . . 50.109999999999999 112.523 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.426 ' O ' HG23 ' A' ' 5' ' ' VAL . 6.5 mm-40 -92.23 163.85 13.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.854 0.359 . . . . 64.420000000000002 110.927 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -113.19 122.02 46.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 64.319999999999993 110.879 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.797 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 2.3 mm? -117.1 151.69 36.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 75.0 110.925 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.78 112.58 24.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.469 . . . . 74.239999999999995 110.886 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.698 HD11 ' HB2' ' A' ' 4' ' ' ALA . 68.9 mt -77.88 143.35 12.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.107 -0.497 . . . . 71.439999999999998 111.124 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -118.94 -41.74 2.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.159 -0.473 . . . . 53.5 110.883 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.438 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -158.95 174.17 15.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.231 -0.441 . . . . 72.129999999999995 111.111 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.553 ' ND1' HD13 ' A' ' 81' ' ' ILE . 1.7 p80 -127.71 178.84 5.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.449 . . . . 64.420000000000002 110.869 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -138.34 100.25 4.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 75.319999999999993 110.895 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 45.9 t0 54.98 25.49 6.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 71.099999999999994 110.856 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.624 ' HD2' HD12 ' A' ' 81' ' ' ILE . 24.7 m-85 63.86 16.03 9.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.244 -0.435 . . . . 72.230000000000004 110.927 -179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.567 ' O ' HG23 ' A' ' 52' ' ' VAL . 28.9 mm-40 -103.46 -50.04 3.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 75.349999999999994 110.866 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 81.6 m95 -112.42 164.64 13.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.12 -0.491 . . . . 73.439999999999998 110.923 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.696 ' CD1' HG22 ' A' ' 52' ' ' VAL . 3.3 m-85 -138.23 155.94 48.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 73.540000000000006 110.884 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 11.5 mm -113.94 94.29 3.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.133 -0.485 . . . . 70.010000000000005 111.079 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.797 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -108.28 146.69 32.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 54.130000000000003 111.078 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.3 mttm -115.79 153.91 48.09 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.571 0.701 . . . . 72.420000000000002 110.886 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 118.67 5.82 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.664 2.242 . . . . 61.310000000000002 112.311 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 30.6 mt -89.21 -22.49 6.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.189 -0.46 . . . . 54.229999999999997 111.149 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' A ASN . . . . . . . . . . . . . 28.7 t-20 -73.32 -66.36 0.7 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 73.450000000000003 110.833 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' B ARG . . . . . . . . . . . . . 9.5 ptp85 -74.34 -172.98 1.57 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 63.43 110.905 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.9 mt -55.21 -74.61 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 65.099999999999994 110.934 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -167.97 164.33 37.88 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.73 -0.748 . . . . 65.519999999999996 112.454 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.489 ' O ' HD22 ' A' ' 18' ' ' LEU . . . 167.61 76.07 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.751 -0.738 . . . . 75.25 112.467 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 113.05 3.25 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.69 2.26 . . . . 73.420000000000002 112.329 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -117.86 -131.27 4.44 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.752 -0.737 . . . . 71.239999999999995 112.488 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.4 HD23 ' HD2' ' B' ' -7' ' ' PHE . 0.0 OUTLIER -146.04 128.35 15.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.845 0.355 . . . . 71.109999999999999 110.91 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.7 p -142.98 131.06 11.23 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.616 0.722 . . . . 73.239999999999995 111.146 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.662 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.4 Cg_endo -69.82 163.0 39.96 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.698 2.266 . . . . 75.099999999999994 112.283 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.78 HG12 ' HB ' ' A' ' 71' ' ' THR . 9.6 t -69.88 -21.64 24.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.221 -0.445 . . . . 74.239999999999995 111.155 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.2 m -80.48 -0.23 36.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.145 -0.48 . . . . 74.450000000000003 110.83 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -124.36 12.88 8.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.132 -0.486 . . . . 74.200000000000003 110.945 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.662 HG22 ' O ' ' A' ' 51' ' ' PRO . 10.3 m -152.84 139.27 12.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 73.219999999999999 111.164 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.557 ' HG2' HG23 ' A' ' 58' ' ' ILE . 19.6 ttm180 -112.08 119.74 39.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 73.049999999999997 110.861 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 16.5 mm -66.54 109.29 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 75.150000000000006 111.162 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.557 HG23 ' HG2' ' A' ' 56' ' ' ARG . 1.2 pt -131.6 128.19 60.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.466 . . . . 45.439999999999998 111.157 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.72 126.28 27.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 74.219999999999999 110.89 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.462 HD22 ' CZ ' ' A' ' 3' ' ' PHE . 17.1 tp -58.26 -29.77 66.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 73.400000000000006 110.941 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 9.0 mmt -88.64 -1.45 58.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 74.420000000000002 110.849 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -170.88 82.6 0.53 Allowed Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.602 0.715 . . . . 75.329999999999998 110.909 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.739 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 54.0 Cg_endo -69.72 -7.12 20.23 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.678 2.252 . . . . 74.209999999999994 112.398 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -100.69 -2.64 32.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 71.129999999999995 111.14 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.3 ttpt -81.58 -52.55 7.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 72.439999999999998 110.888 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.554 ' O ' HG12 ' A' ' 69' ' ' VAL . 32.8 m-85 -104.24 23.51 12.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.271 -0.422 . . . . 74.140000000000001 110.934 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.739 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -79.88 -18.24 51.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 72.450000000000003 111.117 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.8 p -106.12 22.85 15.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 63.109999999999999 110.875 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 1.05 HG21 HD11 ' A' ' 80' ' ' ILE . 8.0 p -90.86 149.2 4.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.15 -0.477 . . . . 74.010000000000005 111.165 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -98.61 83.85 3.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 62.350000000000001 110.87 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.78 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.1 OUTLIER -51.25 -44.57 61.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 61.329999999999998 111.113 -179.883 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -54.15 -40.63 67.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 73.129999999999995 110.943 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 61.4 t0 -63.71 107.34 1.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.491 . . . . 73.019999999999996 110.843 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.7 -28.56 22.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 61.229999999999997 110.831 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -66.89 -56.26 11.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 53.450000000000003 110.874 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 2.4 mm-40 -59.25 -56.1 26.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 65.430000000000007 110.908 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.5 p -53.14 -32.12 18.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 75.340000000000003 111.135 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 12.2 mtm -67.47 -54.55 19.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 72.439999999999998 110.887 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.6 mttp -55.63 -39.28 70.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.445 . . . . 72.109999999999999 110.906 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 1.05 HD11 HG21 ' A' ' 69' ' ' VAL . 83.3 mt -64.34 -54.9 25.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 71.040000000000006 111.156 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.782 HG23 ' HB ' ' A' ' 86' ' ' ILE . 97.1 mt -59.91 -35.36 60.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 74.420000000000002 111.166 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -69.09 -49.38 57.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.175 -0.466 . . . . 60.43 110.894 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -62.23 -43.57 98.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 73.329999999999998 110.879 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -75.5 -18.23 59.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 71.439999999999998 110.857 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 60.1 mmtt 63.18 49.53 3.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 72.420000000000002 110.904 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.782 ' HB ' HG23 ' A' ' 81' ' ' ILE . 21.1 mt -77.33 129.65 77.02 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.618 0.723 . . . . 64.129999999999995 111.156 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.438 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 54.2 Cg_endo -69.74 163.29 38.8 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.704 2.269 . . . . 74.400000000000006 112.356 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.85 166.17 12.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.248 -0.433 . . . . 72.099999999999994 111.108 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 91.4 t -50.66 -54.58 9.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 65.340000000000003 111.128 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -51.34 -49.11 62.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.173 -0.467 . . . . 61.420000000000002 110.917 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -56.98 -46.47 82.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 52.450000000000003 110.919 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -59.14 -37.79 78.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.228 -0.442 . . . . 74.209999999999994 110.91 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.09 -43.53 82.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.231 -0.44 . . . . 75.409999999999997 110.892 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -65.5 -36.07 82.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.263 -0.426 . . . . 73.530000000000001 110.858 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -72.96 -38.0 66.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 70.310000000000002 110.913 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 5.9 p -74.85 -44.33 49.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 64.319999999999993 111.168 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.6 -34.46 77.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 74.430000000000007 110.839 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 10.6 ptt85 -80.22 -32.28 38.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.191 -0.459 . . . . 71.129999999999995 110.886 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -80.8 -23.61 39.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 71.120000000000005 110.924 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.7 mmmm -88.41 -17.08 31.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.133 -0.485 . . . . 72.030000000000001 110.906 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -51.09 167.73 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 72.340000000000003 110.918 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.2 p -90.69 78.19 6.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.158 -0.474 . . . . 72.310000000000002 110.819 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 75.0 m -100.92 -174.83 2.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.117 -0.492 . . . . 64.329999999999998 110.846 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.405 HG22 ' N ' ' A' ' 105' ' ' GLN . 7.6 mm -98.88 160.73 3.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 62.539999999999999 111.126 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.405 ' N ' HG22 ' A' ' 104' ' ' ILE . 2.8 mt-30 -69.48 -168.79 0.18 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.124 -0.489 . . . . 74.430000000000007 110.915 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.2 mp -131.2 134.42 61.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.155 -0.475 . . . . 62.100000000000001 111.12 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -81.31 64.3 4.19 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.759 -0.734 . . . . 72.010000000000005 112.486 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 23.6 p-10 -106.27 141.75 37.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.85 0.357 . . . . 65.209999999999994 110.891 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -107.78 178.94 21.77 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.74 -0.743 . . . . 44.219999999999999 112.469 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 41.6 m80 -109.25 162.1 14.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.894 0.378 . . . . 63.219999999999999 110.807 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -77.09 -162.98 17.06 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.719 -0.753 . . . . 61.539999999999999 112.465 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -153.18 154.6 35.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.801 0.334 . . . . 72.530000000000001 110.902 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.4 m -136.53 126.96 26.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 63.539999999999999 110.864 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -165.53 140.65 4.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.117 -0.492 . . . . 70.329999999999998 110.877 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -135.5 99.9 0.33 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.773 -0.727 . . . . 72.329999999999998 112.507 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 49.6 mt -80.81 -61.12 2.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.814 0.34 . . . . 63.409999999999997 110.924 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 73.540000000000006 110.885 179.939 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 N-CA-C 112.525 -0.23 . . . . 54.210000000000001 112.525 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.16 -33.03 4.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.884 0.373 . . . . 71.129999999999995 110.935 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' -7' ' ' PHE . . . . . 0.4 ' HD2' HD23 ' A' ' 49' ' ' LEU . 31.8 m-85 -72.14 -75.13 0.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 71.409999999999997 110.845 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 31.2 mm 51.18 81.42 0.26 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.649 0.738 . . . . 62.219999999999999 111.146 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 81.7 0.81 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.676 2.251 . . . . 61.539999999999999 112.323 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 40.6 t -89.06 3.0 53.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.24 -0.436 . . . . 74.010000000000005 110.84 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -50.97 162.83 0.55 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.606 0.717 . . . . 64.450000000000003 110.836 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 -23.05 31.36 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.684 2.256 . . . . 51.030000000000001 112.344 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.01 90.49 0.09 OUTLIER Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.583 0.706 . . . . 71.019999999999996 111.07 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 158.41 57.0 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.71 2.273 . . . . 63.32 112.311 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.97 150.38 40.47 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.566 0.698 . . . . 72.549999999999997 110.926 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 166.21 28.36 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.622 2.214 . . . . 73.120000000000005 112.358 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.82 111.99 2.97 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.656 2.237 . . . . 75.5 112.342 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -55.22 -40.26 70.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 75.219999999999999 110.874 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 4.1 p -52.27 -35.02 48.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.124 -0.489 . . . . 64.219999999999999 110.826 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 65.310000000000002 111.06 179.92 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 3.8 ptt? . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.766 0.317 . . . . 73.219999999999999 110.884 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' -1' ' ' ALA . . . . . 0.584 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -93.97 160.15 32.95 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.565 0.698 . . . . 51.539999999999999 111.071 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.584 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 54.1 Cg_endo -69.72 120.09 6.93 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.687 2.258 . . . . 73.540000000000006 112.364 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.447 HD11 ' HB ' ' A' ' 28' ' ' ILE . 0.7 OUTLIER -118.93 156.17 30.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.24 -0.437 . . . . 74.109999999999999 110.932 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.599 ' HB2' HD23 ' A' ' 60' ' ' LEU . 68.0 m-85 -139.49 163.42 32.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 75.099999999999994 110.887 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.504 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -134.44 167.15 21.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.149 -0.478 . . . . 53.210000000000001 111.098 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.3 p -128.51 128.86 68.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 74.319999999999993 111.157 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.693 HG21 HG11 ' A' ' 20' ' ' VAL . 0.7 OUTLIER -72.16 138.42 47.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 63.43 111.132 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.632 HD11 ' HB2' ' A' ' 56' ' ' ARG . 18.0 mt -114.47 -15.39 12.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.229 -0.441 . . . . 62.350000000000001 110.956 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -137.42 158.35 44.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.139 -0.482 . . . . 73.099999999999994 110.927 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -83.04 104.83 13.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.1 -0.5 . . . . 64.349999999999994 110.874 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -88.96 103.81 16.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.192 -0.458 . . . . 73.129999999999995 110.892 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.1 mttm -79.4 112.05 16.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 62.340000000000003 110.918 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.616 ' HB1' ' HB2' ' A' ' 17' ' ' GLU . . . -71.85 163.11 28.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.237 -0.438 . . . . 63.049999999999997 111.122 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -119.01 -31.46 4.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.456 . . . . 73.439999999999998 110.909 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.1 mmm-85 -139.38 -174.76 3.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 55.149999999999999 110.814 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -64.54 -39.93 94.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 45.420000000000002 110.823 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.41 -28.0 40.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.194 -0.457 . . . . 73.319999999999993 110.87 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.616 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 40.0 mm-40 -88.98 -178.16 5.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 74.420000000000002 110.909 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.585 HD13 ' O ' ' A' ' 46' ' ' GLY . 56.6 tp -150.41 123.18 8.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.122 -0.49 . . . . 60.240000000000002 110.912 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -80.53 124.52 29.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.214 -0.448 . . . . 72.349999999999994 110.913 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.693 HG11 HG21 ' A' ' 6' ' ' THR . 7.4 p -139.53 155.06 25.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.441 . . . . 62.299999999999997 111.123 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.0 m -111.11 159.34 33.08 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.65 0.738 . . . . 75.219999999999999 110.829 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 123.01 9.67 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.642 2.228 . . . . 72.409999999999997 112.32 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.41 -3.32 32.81 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.775 -0.726 . . . . 61.049999999999997 112.488 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -89.98 145.7 24.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.891 0.377 . . . . 75.310000000000002 110.874 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -86.67 142.06 28.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 75.310000000000002 110.842 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.54 HD11 HG21 ' A' ' 20' ' ' VAL . 5.3 mp -144.46 151.91 39.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.466 . . . . 71.409999999999997 110.922 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.5 t -107.08 125.56 51.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 64.129999999999995 110.876 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.504 HD11 ' HB2' ' A' ' 4' ' ' ALA . 53.5 mt -86.06 143.97 10.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 71.530000000000001 111.146 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 23.5 m -112.55 -37.72 4.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.18 -0.464 . . . . 74.049999999999997 110.922 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -164.27 176.16 9.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 74.510000000000005 111.129 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.428 ' CE1' HG21 ' A' ' 81' ' ' ILE . 1.6 p80 -126.61 178.26 6.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 74.409999999999997 110.876 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.73 ' OH ' HG23 ' B' ' -6' ' ' ILE . 40.5 t80 -141.03 99.65 3.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.211 -0.45 . . . . 72.25 110.903 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 54.92 24.01 5.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.129 -0.487 . . . . 62.009999999999998 110.858 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.593 ' HD2' HD12 ' A' ' 81' ' ' ILE . 35.7 m-85 63.6 15.3 8.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.201 -0.454 . . . . 75.030000000000001 110.92 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.431 ' O ' HG23 ' A' ' 52' ' ' VAL . 22.0 mm-40 -103.32 -49.17 3.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.498 . . . . 74.430000000000007 110.896 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -114.52 146.16 41.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 70.409999999999997 110.918 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.726 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -119.18 149.11 42.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.435 . . . . 75.340000000000003 110.897 -179.965 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.2 mm -108.53 96.27 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 74.25 111.103 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.464 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -105.71 161.62 14.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 73.200000000000003 111.133 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -136.59 158.32 73.45 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.534 0.683 . . . . 71.140000000000001 110.879 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.79 131.87 22.1 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.689 2.26 . . . . 64.310000000000002 112.372 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 27.0 mm -81.59 -45.55 20.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.446 . . . . 75.129999999999995 111.104 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' A ASN . . . . . . . . . . . . . 2.7 m120 -109.64 -44.26 3.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 71.099999999999994 110.928 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' B ARG . . . . . . . . . . . . . 4.2 mmt180 -51.8 169.87 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 72.439999999999998 110.844 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.3 mp -54.75 120.35 6.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 74.140000000000001 110.923 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -47.2 120.22 5.29 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.753 -0.736 . . . . 63.539999999999999 112.517 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.585 ' O ' HD13 ' A' ' 18' ' ' LEU . . . 178.16 81.84 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.767 -0.73 . . . . 53.229999999999997 112.474 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 141.03 44.09 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.701 2.267 . . . . 63.399999999999999 112.337 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -126.19 -105.34 1.44 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.719 -0.753 . . . . 62.210000000000001 112.447 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -162.63 125.69 2.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.85 0.357 . . . . 63.25 110.896 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.413 HG23 ' HD2' ' A' ' 51' ' ' PRO . 10.0 p -136.51 132.99 18.95 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.583 0.706 . . . . 74.420000000000002 111.107 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.51 ' O ' HG22 ' A' ' 55' ' ' VAL . 54.0 Cg_endo -69.74 144.87 55.53 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.686 2.257 . . . . 61.409999999999997 112.347 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.726 HG22 ' CD2' ' A' ' 37' ' ' PHE . 18.4 t -58.24 -22.15 19.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 72.239999999999995 111.16 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.1 m -77.61 -2.55 36.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.476 . . . . 71.519999999999996 110.814 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.443 ' O ' HG13 ' A' ' 55' ' ' VAL . 10.8 m-85 -125.82 22.93 7.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.485 . . . . 73.349999999999994 110.91 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.51 HG22 ' O ' ' A' ' 51' ' ' PRO . 1.7 m -156.27 154.75 6.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.121 -0.491 . . . . 60.130000000000003 111.121 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.632 ' HB2' HD11 ' A' ' 7' ' ' LEU . 37.6 ttm-85 -121.41 128.44 52.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 74.540000000000006 110.873 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.631 HD11 ' CE2' ' A' ' 37' ' ' PHE . 42.5 mm -76.72 110.02 11.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.183 -0.462 . . . . 52.32 111.136 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.404 HG23 ' HG2' ' A' ' 56' ' ' ARG . 7.0 pt -126.13 -177.78 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.479 . . . . 54.439999999999998 111.082 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -126.09 124.48 40.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.162 -0.472 . . . . 45.399999999999999 110.895 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.599 HD23 ' HB2' ' A' ' 3' ' ' PHE . 0.4 OUTLIER -55.02 -26.39 36.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 74.219999999999999 110.913 -179.94 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.6 mpp? -90.17 -25.57 20.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 64.5 110.917 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -147.83 75.0 11.11 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.601 0.715 . . . . 63.409999999999997 110.872 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.724 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.8 Cg_endo -69.79 -8.39 23.49 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.676 2.251 . . . . 73.430000000000007 112.331 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -100.14 -12.92 19.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 52.009999999999998 111.132 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.5 ttmm -80.02 -52.1 8.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 52.340000000000003 110.908 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.435 ' O ' HG12 ' A' ' 69' ' ' VAL . 78.9 m-85 -95.45 23.11 6.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.446 . . . . 75.430000000000007 110.931 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.724 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -90.06 9.91 26.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 74.230000000000004 111.101 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 64.4 p -116.62 -24.13 7.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.221 -0.445 . . . . 74.450000000000003 110.796 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.527 HG21 ' CD1' ' A' ' 80' ' ' ILE . 13.9 p -56.65 135.28 20.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.17 -0.468 . . . . 71.329999999999998 111.12 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -90.33 100.67 13.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 74.140000000000001 110.848 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.698 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -57.78 -30.47 65.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 71.150000000000006 111.115 -179.851 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -62.72 -44.64 95.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.228 -0.442 . . . . 73.319999999999993 110.916 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.6 t0 -63.72 106.56 1.0 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.491 . . . . 72.519999999999996 110.869 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.44 -27.94 27.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 72.430000000000007 110.851 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -66.52 -54.46 23.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 74.019999999999996 110.884 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.455 ' O ' HD12 ' A' ' 80' ' ' ILE . 28.2 mt-30 -59.75 -57.62 12.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.146 -0.479 . . . . 73.450000000000003 110.912 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 4.3 p -51.89 -32.76 15.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 72.510000000000005 111.12 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 16.5 mtm -67.87 -50.82 54.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 54.240000000000002 110.902 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.4 mttt -56.28 -43.86 79.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.254 -0.43 . . . . 52.409999999999997 110.854 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.591 HG21 HG21 ' A' ' 57' ' ' ILE . 1.6 mp -63.97 -54.82 26.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 74.109999999999999 111.131 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.651 HG23 ' HB ' ' A' ' 86' ' ' ILE . 87.2 mt -57.68 -37.02 56.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.222 -0.445 . . . . 72.530000000000001 111.129 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -71.07 -51.71 23.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.21 -0.45 . . . . 64.239999999999995 110.834 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -59.47 -50.26 74.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 74.5 110.898 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -67.88 -13.42 62.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 71.099999999999994 110.906 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 63.1 mmtt 61.11 48.36 6.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.097 -0.501 . . . . 73.430000000000007 110.906 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.651 ' HB ' HG23 ' A' ' 81' ' ' ILE . 24.6 mt -81.66 122.43 80.48 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.651 0.739 . . . . 71.109999999999999 111.118 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.8 159.49 53.2 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.703 2.269 . . . . 72.530000000000001 112.32 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.407 HG22 ' O ' ' A' ' 31' ' ' HIS . 0.1 OUTLIER -81.38 174.81 11.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.216 -0.447 . . . . 73.420000000000002 111.1 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.817 HG12 ' HE2' ' A' ' 93' ' ' LYS . 24.1 t -53.81 -58.53 3.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.459 . . . . 62.219999999999999 111.136 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -50.75 -47.68 59.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 72.329999999999998 110.874 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -56.12 -39.24 71.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.458 . . . . 73.549999999999997 110.912 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -62.03 -48.43 80.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 73.439999999999998 110.89 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.817 ' HE2' HG12 ' A' ' 89' ' ' VAL . 17.7 mtmt -58.09 -50.79 72.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.217 -0.447 . . . . 73.230000000000004 110.897 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -58.35 -51.68 68.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.258 -0.428 . . . . 53.140000000000001 110.865 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -50.63 -52.56 38.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 75.400000000000006 110.897 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.86 -39.05 76.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 74.329999999999998 111.118 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -59.33 -45.51 91.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.248 -0.433 . . . . 71.200000000000003 110.883 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 -65.13 -45.22 85.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 52.240000000000002 110.84 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 24.3 t80 -67.53 -25.13 65.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.459 . . . . 60.25 110.925 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.8 mtpm? -88.07 -25.81 22.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.118 -0.492 . . . . 71.400000000000006 110.907 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -93.4 -176.16 4.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.208 -0.451 . . . . 73.019999999999996 110.884 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 7.7 t -52.08 158.35 1.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.476 . . . . 65.329999999999998 110.86 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.68 176.7 7.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 61.310000000000002 110.812 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 4.9 mm -105.82 162.36 5.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.125 -0.489 . . . . 73.519999999999996 111.154 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -52.14 171.39 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 74.010000000000005 110.941 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.7 mp -117.92 98.31 6.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 64.420000000000002 111.114 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -134.23 107.78 0.68 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.693 -0.765 . . . . 74.420000000000002 112.486 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -76.88 133.05 39.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.856 0.36 . . . . 72.409999999999997 110.906 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -117.59 100.78 0.89 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.739 -0.743 . . . . 43.399999999999999 112.481 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -145.58 156.41 43.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.839 0.352 . . . . 72.430000000000007 110.865 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 159.56 114.56 0.38 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.788 -0.72 . . . . 64.450000000000003 112.497 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -175.64 149.2 0.95 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.786 0.327 . . . . 75.340000000000003 110.915 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 65.9 m -141.85 172.64 12.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 63.25 110.896 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -151.61 166.52 30.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 73.409999999999997 110.931 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -140.56 137.74 8.5 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.723 -0.751 . . . . 60.439999999999998 112.468 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 73.7 mt -110.01 -179.73 3.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.755 0.312 . . . . 74.219999999999999 110.923 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 53.520000000000003 110.897 179.964 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 N-CA-C 112.458 -0.257 . . . . 62.450000000000003 112.458 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 4.6 tttp -137.25 -51.76 0.66 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.815 0.341 . . . . 71.430000000000007 110.866 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 -94.11 -78.21 0.44 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 72.049999999999997 110.866 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' -6' ' ' ILE . . . . . 0.73 HG23 ' OH ' ' A' ' 32' ' ' TYR . 3.5 mp 47.95 84.73 0.19 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.618 0.723 . . . . 74.409999999999997 111.103 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 85.53 0.61 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.688 2.259 . . . . 72.439999999999998 112.361 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 1.3 t -74.28 -8.47 56.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.216 -0.447 . . . . 61.310000000000002 110.888 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.08 160.39 6.37 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.609 0.719 . . . . 71.209999999999994 110.872 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 154.65 67.72 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.688 2.258 . . . . 74.329999999999998 112.333 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -107.92 87.42 3.73 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.565 0.698 . . . . 70.129999999999995 111.108 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 149.0 66.57 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.721 2.281 . . . . 74.319999999999993 112.374 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.0 159.91 64.5 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.58 0.705 . . . . 74.439999999999998 110.86 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 167.11 25.46 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.626 2.217 . . . . 54.409999999999997 112.351 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -36.45 10.69 Favored 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.69 2.26 . . . . 64.239999999999995 112.335 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 19.4 t -106.99 121.29 44.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.265 -0.425 . . . . 74.140000000000001 110.839 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 50.6 m -122.15 97.8 5.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.484 . . . . 71.140000000000001 110.841 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 74.239999999999995 111.065 179.927 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 20.7 ptm . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.762 0.315 . . . . 45.310000000000002 110.922 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' -1' ' ' ALA . . . . . 0.568 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -130.66 160.3 66.93 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.582 0.706 . . . . 55.439999999999998 111.089 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.568 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.1 Cg_endo -69.82 86.73 0.58 Allowed 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.708 2.272 . . . . 54.219999999999999 112.302 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -95.31 149.86 20.88 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.209 -0.451 . . . . 62.43 110.96 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.474 ' CE1' HD12 ' A' ' 60' ' ' LEU . 14.0 m-85 -128.23 163.14 25.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.209 -0.45 . . . . 71.25 110.913 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.428 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -134.6 170.05 16.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 73.519999999999996 111.122 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 24' ' ' GLU . 8.4 p -133.14 131.27 58.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 74.319999999999993 111.092 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.723 HG21 ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -75.05 134.53 41.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 71.040000000000006 111.171 179.98 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.66 HD11 ' HB2' ' A' ' 56' ' ' ARG . 15.6 mt -109.22 -13.05 14.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 62.130000000000003 110.919 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -137.31 156.23 48.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 70.140000000000001 110.896 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -83.55 104.98 14.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.11 -0.495 . . . . 54.200000000000003 110.886 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -108.72 102.43 11.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.178 -0.465 . . . . 74.209999999999994 110.848 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp -78.96 124.34 28.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.114 -0.494 . . . . 73.450000000000003 110.928 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.588 ' HB1' ' HB2' ' A' ' 17' ' ' GLU . . . -65.41 145.4 56.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 72.239999999999995 111.105 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -96.65 -31.62 12.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 55.399999999999999 110.899 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -140.21 179.17 6.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.136 -0.484 . . . . 75.239999999999995 110.907 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -59.87 -29.78 68.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.216 -0.447 . . . . 75.040000000000006 110.906 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -65.15 -24.56 67.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 64.5 110.868 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.588 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 44.4 mm-40 -104.79 147.92 27.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.459 . . . . 71.430000000000007 110.896 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.546 HD13 ' O ' ' A' ' 46' ' ' GLY . 5.2 tp -118.12 119.18 33.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.165 -0.47 . . . . 74.409999999999997 110.965 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -57.31 141.34 47.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 63.539999999999999 110.865 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.723 ' HB ' HG21 ' A' ' 6' ' ' THR . 0.8 OUTLIER -145.4 158.69 13.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 73.239999999999995 111.124 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.5 m -129.09 160.32 64.33 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.656 0.741 . . . . 73.109999999999999 110.877 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 119.46 6.41 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.687 2.258 . . . . 72.239999999999995 112.374 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.49 -0.46 30.86 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.741 -0.742 . . . . 51.409999999999997 112.468 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.559 ' O ' HG23 ' A' ' 5' ' ' VAL . 4.7 mp0 -88.24 166.0 14.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.82 0.343 . . . . 70.209999999999994 110.888 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.468 ' CB ' HD12 ' A' ' 42' ' ' ILE . 4.4 m120 -117.38 127.03 53.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 64.430000000000007 110.917 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.589 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 2.2 mp -127.41 158.99 35.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 74.340000000000003 110.917 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.0 t -111.13 114.87 28.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 74.200000000000003 110.878 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.428 HD11 ' HB2' ' A' ' 4' ' ' ALA . 57.2 mt -79.69 144.61 10.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 75.129999999999995 111.143 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 29.3 m -118.36 -41.65 2.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 74.340000000000003 110.899 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.411 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -155.67 174.63 15.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 74.420000000000002 111.093 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.471 ' ND1' HD13 ' A' ' 81' ' ' ILE . 1.3 p80 -126.89 177.73 6.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 70.209999999999994 110.868 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.2 t80 -139.91 99.56 3.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 75.319999999999993 110.941 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 55.11 25.16 6.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 64.019999999999996 110.843 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.59 ' HD2' HD12 ' A' ' 81' ' ' ILE . 34.2 m-85 63.48 16.3 9.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.225 -0.443 . . . . 74.109999999999999 110.935 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.465 ' O ' HG23 ' A' ' 52' ' ' VAL . 12.2 mm-40 -103.62 -50.32 3.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 73.510000000000005 110.935 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.427 ' CZ2' ' HB2' ' B' ' -3' ' ' ARG . 78.5 m95 -113.06 153.78 27.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.09 -0.505 . . . . 75.540000000000006 110.923 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.634 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.4 OUTLIER -126.38 142.64 51.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.25 -0.432 . . . . 71.319999999999993 110.933 -179.998 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 21.7 mm -99.16 95.64 4.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.154 -0.475 . . . . 74.239999999999995 111.109 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.589 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -108.1 152.86 23.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.461 . . . . 73.140000000000001 111.13 179.754 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.2 mtpt -125.1 159.49 59.03 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.589 0.709 . . . . 74.420000000000002 110.905 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.7 139.74 41.17 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.67 2.247 . . . . 74.549999999999997 112.381 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.468 HD12 ' CB ' ' A' ' 25' ' ' ASN . 44.2 mt -101.33 -23.65 4.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.447 . . . . 75.310000000000002 111.177 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' A ASN . . . . . . . . . . . . . 20.6 t-20 -92.83 -32.35 14.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 73.299999999999997 110.879 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' B ARG . . . . . . . . . . . . . 15.5 mmp_? -73.2 -168.98 0.56 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 75.319999999999993 110.893 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.16 12.08 36.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 74.219999999999999 110.964 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 119.85 124.24 3.19 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.742 -0.742 . . . . 73.010000000000005 112.487 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.546 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -171.01 76.67 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.752 -0.737 . . . . 51.340000000000003 112.458 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 116.97 4.81 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.654 2.236 . . . . 64.540000000000006 112.357 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -116.91 -111.8 2.65 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.751 -0.738 . . . . 71.349999999999994 112.518 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -172.12 124.61 0.52 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.843 0.354 . . . . 65.239999999999995 110.949 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.42 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.1 p -139.46 132.98 15.65 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.58 0.705 . . . . 64.230000000000004 111.146 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.579 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.1 Cg_endo -69.75 160.58 49.19 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.66 2.24 . . . . 73.230000000000004 112.325 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.764 HG12 ' HB ' ' A' ' 71' ' ' THR . 8.4 t -72.11 -20.97 20.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 64.019999999999996 111.114 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.0 m -79.15 -0.17 30.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 72.439999999999998 110.832 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -127.49 17.36 7.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 71.409999999999997 110.947 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.579 HG22 ' O ' ' A' ' 51' ' ' PRO . 16.8 m -151.87 161.15 3.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.086 -0.507 . . . . 53.43 111.115 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.66 ' HB2' HD11 ' A' ' 7' ' ' LEU . 39.0 ttm-85 -128.99 131.75 47.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.166 -0.47 . . . . 61.32 110.845 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.404 HG21 HG21 ' A' ' 80' ' ' ILE . 31.1 mm -80.59 108.85 14.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 75.430000000000007 111.124 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.445 HG23 ' HG2' ' A' ' 56' ' ' ARG . 4.6 pt -126.81 140.19 49.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 64.540000000000006 111.078 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -76.36 128.57 35.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.136 -0.483 . . . . 71.049999999999997 110.872 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.474 HD12 ' CE1' ' A' ' 3' ' ' PHE . 0.6 OUTLIER -60.42 -34.97 74.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.181 -0.463 . . . . 73.340000000000003 110.872 -179.943 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.1 mmt -83.78 -1.6 54.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 73.040000000000006 110.894 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -178.91 82.93 0.21 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.665 0.745 . . . . 62.020000000000003 110.884 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.724 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.3 Cg_endo -69.81 -7.93 22.31 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.704 2.27 . . . . 71.310000000000002 112.284 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.46 -8.49 44.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 73.120000000000005 111.146 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -81.97 -47.09 13.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 62.210000000000001 110.883 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.641 ' O ' HG12 ' A' ' 69' ' ' VAL . 14.2 m-85 -103.72 23.47 12.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 73.310000000000002 110.916 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.724 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -84.23 -16.87 41.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 54.009999999999998 111.09 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 39.8 p -94.18 -23.76 17.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 71.340000000000003 110.829 -179.734 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.988 HG21 HD11 ' A' ' 80' ' ' ILE . 9.8 p -51.33 155.95 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.083 -0.508 . . . . 73.230000000000004 111.168 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -113.31 106.77 15.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 75.420000000000002 110.857 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.764 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.1 OUTLIER -70.5 -20.81 62.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.445 . . . . 75.030000000000001 111.14 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -62.77 -54.91 31.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.231 -0.441 . . . . 74.109999999999999 110.91 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -63.89 116.73 6.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 73.540000000000006 110.893 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.48 -22.14 41.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 75.150000000000006 110.896 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -66.84 -56.01 12.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.175 -0.466 . . . . 74.340000000000003 110.928 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 2.0 mm-40 -58.71 -57.12 14.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 62.240000000000002 110.924 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.513 ' HA ' HD12 ' A' ' 80' ' ' ILE . 3.2 p -52.72 -31.91 16.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 73.200000000000003 111.13 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.8 mtm -67.57 -55.12 14.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 61.229999999999997 110.865 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 50.8 mttt -55.36 -38.64 69.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 75.239999999999995 110.944 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.988 HD11 HG21 ' A' ' 69' ' ' VAL . 15.4 mt -65.3 -53.08 44.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.226 -0.443 . . . . 73.530000000000001 111.105 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.721 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.1 mt -61.95 -35.9 70.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 73.019999999999996 111.145 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -71.02 -44.77 65.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 72.409999999999997 110.905 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -67.89 -47.84 67.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 71.200000000000003 110.891 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -69.21 -11.5 60.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 74.5 110.86 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 45.9 mmtt 58.32 53.89 6.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.461 . . . . 72.450000000000003 110.887 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.721 ' HB ' HG23 ' A' ' 81' ' ' ILE . 23.7 mt -88.14 124.33 66.88 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 75.239999999999995 111.134 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.411 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 53.3 Cg_endo -69.76 164.15 35.63 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.642 2.228 . . . . 54.439999999999998 112.33 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.97 167.33 13.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 65.409999999999997 111.128 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.473 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 97.7 t -50.61 -58.41 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 74.129999999999995 111.122 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -46.05 -53.16 10.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 72.129999999999995 110.906 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 74.9 mm-40 -56.38 -34.16 66.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 63.009999999999998 110.913 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' TRP . . . . . 0.453 ' O ' HG23 ' A' ' 96' ' ' THR . 26.8 t90 -71.25 -36.2 71.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.199 -0.455 . . . . 74.530000000000001 110.878 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' A' ' 89' ' ' VAL . 1.6 mmmt -68.62 -37.56 79.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.451 . . . . 71.230000000000004 110.917 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -71.38 -50.83 28.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.227 -0.442 . . . . 74.230000000000004 110.888 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLN . . . . . 0.412 ' HG2' ' HA ' ' A' ' 92' ' ' TRP . 5.1 pt20 -58.8 -38.83 79.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.194 -0.457 . . . . 73.129999999999995 110.867 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 96' ' ' THR . . . . . 0.453 HG23 ' O ' ' A' ' 92' ' ' TRP . 26.2 p -70.56 -47.47 60.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.251 -0.431 . . . . 62.340000000000003 111.093 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -56.19 -45.04 79.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.445 . . . . 72.430000000000007 110.867 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 6.0 ptm180 -74.3 -34.87 63.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.243 -0.435 . . . . 63.329999999999998 110.857 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -64.22 -35.26 80.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.177 -0.465 . . . . 71.439999999999998 110.939 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 38.2 mmtt -77.69 -25.5 49.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.109 -0.496 . . . . 73.019999999999996 110.922 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -67.94 176.69 2.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 71.430000000000007 110.872 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 30.0 t -58.05 113.87 2.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 70.099999999999994 110.856 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 17.1 m -160.26 -173.28 3.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 74.420000000000002 110.888 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 12.5 mm -81.07 154.21 4.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 64.420000000000002 111.149 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -171.51 -179.03 2.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 70.150000000000006 110.926 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.1 mp -127.23 104.32 12.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.229 -0.441 . . . . 63.539999999999999 111.122 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 102.03 179.11 27.73 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.751 -0.737 . . . . 63.240000000000002 112.487 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -78.06 120.97 23.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.898 0.38 . . . . 54.520000000000003 110.913 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -89.61 171.85 38.45 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.764 -0.731 . . . . 34.299999999999997 112.502 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 68.6 m80 -119.19 158.82 25.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.91 0.386 . . . . 72.040000000000006 110.829 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -167.48 103.9 0.21 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.747 -0.74 . . . . 65.519999999999996 112.492 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 16.5 mp0 -122.32 170.29 10.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.842 0.353 . . . . 70.409999999999997 110.899 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.2 p -169.44 151.44 4.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 75.019999999999996 110.86 -179.769 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -134.75 153.78 51.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.135 -0.484 . . . . 74.329999999999998 110.939 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -140.82 113.79 0.89 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.789 -0.72 . . . . 71.030000000000001 112.537 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.62 -32.05 7.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.771 0.32 . . . . 51.409999999999997 110.908 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 74.239999999999995 110.909 179.953 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 N-CA-C 112.495 -0.242 . . . . 70.400000000000006 112.495 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 12.1 tptt -71.02 -74.1 0.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.834 0.35 . . . . 63.240000000000002 110.852 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -76.11 -71.83 0.36 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 73.450000000000003 110.91 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.8 mm 51.41 74.37 0.81 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.651 0.739 . . . . 42.030000000000001 111.119 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 101.26 0.9 Allowed 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.703 2.268 . . . . 75.040000000000006 112.326 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 24.2 t -89.33 1.47 55.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 71.099999999999994 110.841 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' -3' ' ' ARG . . . . . 0.427 ' HB2' ' CZ2' ' A' ' 36' ' ' TRP . 19.7 mmt-85 -50.75 160.38 0.79 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.589 0.709 . . . . 74.340000000000003 110.915 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 -22.88 31.62 Favored 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.725 2.283 . . . . 45.420000000000002 112.354 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.6 85.03 0.17 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.585 0.707 . . . . 74.329999999999998 111.122 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 159.45 53.41 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.742 2.295 . . . . 73.140000000000001 112.303 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 11.4 mtpt -94.7 160.08 32.12 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.565 0.698 . . . . 74.129999999999995 110.9 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 166.66 26.76 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.668 2.245 . . . . 63.329999999999998 112.369 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 -23.64 30.6 Favored 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.7 2.267 . . . . 71.409999999999997 112.332 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 2.4 p -52.21 -37.78 55.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.235 -0.438 . . . . 75.209999999999994 110.88 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 2.1 m -132.62 138.34 47.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.144 -0.48 . . . . 64.430000000000007 110.894 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.11 -0.496 . . . . 62.130000000000003 111.135 179.91 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 11.3 tpt . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.823 0.344 . . . . 65.230000000000004 110.866 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' -1' ' ' ALA . . . . . 0.474 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -143.09 156.94 61.46 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.569 0.7 . . . . 71.129999999999995 111.077 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.474 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 54.2 Cg_endo -69.73 83.74 0.68 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.659 2.24 . . . . 72.530000000000001 112.383 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.462 HD23 ' H ' ' A' ' 2' ' ' LEU . 1.3 pt? -67.08 146.06 54.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.46 . . . . 74.319999999999993 110.932 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -112.06 145.15 40.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.258 -0.428 . . . . 65.319999999999993 110.893 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.608 ' HB1' HG13 ' A' ' 55' ' ' VAL . . . -126.66 153.57 45.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 73.310000000000002 111.118 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 24' ' ' GLU . 6.6 p -121.66 122.5 67.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.24 -0.436 . . . . 60.109999999999999 111.129 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -59.18 140.17 56.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 64.310000000000002 111.126 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.586 HD21 ' HB2' ' A' ' 56' ' ' ARG . 3.5 mt -106.04 -16.42 14.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 70.439999999999998 110.907 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -139.25 164.31 30.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 61.240000000000002 110.911 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -87.19 104.8 16.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 72.010000000000005 110.895 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -106.74 109.37 21.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 73.230000000000004 110.86 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -83.84 142.24 30.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.105 -0.498 . . . . 75.439999999999998 110.947 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.62 136.1 50.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.425 . . . . 60.210000000000001 111.093 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -105.53 -26.61 11.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.449 . . . . 72.409999999999997 110.884 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -127.1 -178.59 4.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.49 . . . . 63.43 110.886 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -67.43 -25.97 66.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 64.129999999999995 110.879 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.74 -45.6 15.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 73.010000000000005 110.823 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -55.88 158.27 3.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 70.519999999999996 110.939 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.612 HD13 ' O ' ' A' ' 46' ' ' GLY . 3.4 tp -133.73 145.81 50.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 65.239999999999995 110.918 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -82.65 130.74 35.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 74.129999999999995 110.881 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.989 HG11 HD21 ' A' ' 26' ' ' LEU . 0.2 OUTLIER -139.96 158.93 26.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 75.340000000000003 111.149 179.984 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -125.18 159.09 61.15 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.692 0.758 . . . . 55.299999999999997 110.873 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 117.78 5.29 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.698 2.265 . . . . 72.530000000000001 112.312 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.25 7.12 35.61 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.756 -0.735 . . . . 53.109999999999999 112.495 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.468 ' O ' HG23 ' A' ' 5' ' ' VAL . 24.4 mm-40 -92.2 153.69 19.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.898 0.38 . . . . 44.119999999999997 110.872 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.644 ' HB3' HD12 ' A' ' 42' ' ' ILE . 7.0 m120 -94.8 123.11 38.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.158 -0.474 . . . . 75.439999999999998 110.855 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.989 HD21 HG11 ' A' ' 20' ' ' VAL . 7.9 mp -124.1 149.32 46.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.208 -0.451 . . . . 71.319999999999993 110.907 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.79 123.89 46.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.457 . . . . 63.409999999999997 110.889 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 31.7 mm -74.74 144.84 11.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.132 -0.485 . . . . 72.409999999999997 111.087 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 55.8 m -124.6 -35.2 2.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.134 -0.485 . . . . 64.530000000000001 110.888 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -176.03 171.9 2.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 30.25 111.088 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.474 ' CE1' HG21 ' A' ' 81' ' ' ILE . 1.7 p80 -124.95 173.35 8.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 55.439999999999998 110.86 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -135.39 99.55 4.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.241 -0.436 . . . . 63.219999999999999 110.906 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.8 t0 53.88 26.46 6.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.116 -0.493 . . . . 54.439999999999998 110.878 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.53 ' HD2' HD12 ' A' ' 81' ' ' ILE . 43.7 m-85 62.77 27.77 16.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 64.099999999999994 110.938 -179.81 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -116.69 -48.24 2.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 65.319999999999993 110.9 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 70.1 m95 -114.09 145.86 41.04 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.153 -0.476 . . . . 73.239999999999995 110.942 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.575 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -121.08 139.46 53.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.258 -0.428 . . . . 72.510000000000005 110.9 -179.931 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.6 mm -95.02 95.21 4.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.191 -0.459 . . . . 72.040000000000006 111.124 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.811 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -107.55 145.06 33.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 73.420000000000002 111.102 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -123.53 156.59 64.09 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.567 0.698 . . . . 75.230000000000004 110.89 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 125.71 12.45 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.672 2.248 . . . . 63.210000000000001 112.367 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.644 HD12 ' HB3' ' A' ' 25' ' ' ASN . 58.4 mt -83.85 -35.54 11.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 71.450000000000003 111.131 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' A ASN . . . . . . . . . . . . . 31.8 m-20 -73.57 -44.51 57.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.157 -0.474 . . . . 64.209999999999994 110.917 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' B ARG . . . . . . . . . . . . . 18.8 mmt180 -60.79 -169.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.484 . . . . 74.510000000000005 110.921 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -98.54 -15.9 19.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 71.329999999999998 110.905 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.98 111.97 0.54 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.783 -0.722 . . . . 65.219999999999999 112.524 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.612 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -155.43 66.77 0.31 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.723 -0.751 . . . . 71.409999999999997 112.47 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.68 114.01 3.55 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.678 2.252 . . . . 64.25 112.351 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -116.72 -122.19 3.33 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.787 -0.721 . . . . 65.010000000000005 112.5 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -160.18 125.3 3.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.846 0.355 . . . . 71.239999999999995 110.882 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.426 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.2 p -139.98 133.29 15.23 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.609 0.719 . . . . 51.140000000000001 111.134 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.426 ' HD2' HG23 ' A' ' 50' ' ' VAL . 54.4 Cg_endo -69.75 150.32 68.14 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.683 2.255 . . . . 75.230000000000004 112.378 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.726 HG12 ' HB ' ' A' ' 71' ' ' THR . 21.6 t -58.0 -22.06 18.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 72.420000000000002 111.142 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.9 m -77.97 -2.08 35.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 50.219999999999999 110.822 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -126.1 10.19 7.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 72.140000000000001 110.912 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.608 HG13 ' HB1' ' A' ' 4' ' ' ALA . 2.4 t -147.21 139.73 19.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.494 . . . . 71.319999999999993 111.107 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.586 ' HB2' HD21 ' A' ' 7' ' ' LEU . 31.9 ttm180 -104.97 131.21 52.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 71.140000000000001 110.904 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.496 HG21 HG21 ' A' ' 80' ' ' ILE . 30.0 mm -87.16 108.94 18.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 73.209999999999994 111.126 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.554 HG23 ' HG2' ' A' ' 56' ' ' ARG . 3.1 pt -123.01 160.47 25.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 74.120000000000005 111.101 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 60.8 t0 -97.38 125.38 41.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 74.129999999999995 110.844 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mt -51.65 -37.55 50.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.476 . . . . 52.340000000000003 110.928 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.79 -31.27 35.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.141 -0.481 . . . . 71.109999999999999 110.912 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ASP . . . . . 0.42 ' HB2' ' HB2' ' A' ' 65' ' ' LYS . 0.1 OUTLIER -137.69 78.32 37.22 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.606 0.717 . . . . 72.209999999999994 110.898 179.969 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.766 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.7 Cg_endo -69.8 -8.12 22.8 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.641 2.227 . . . . 61.149999999999999 112.354 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.84 -33.68 11.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 35.399999999999999 111.123 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' LYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 62' ' ' ASP . 0.0 OUTLIER -65.14 -51.8 59.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 50.119999999999997 110.87 179.989 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.525 ' HA ' HG23 ' A' ' 69' ' ' VAL . 20.3 m-85 -90.78 18.95 5.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.436 . . . . 75.040000000000006 110.933 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.766 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -84.14 -23.06 30.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.122 -0.49 . . . . 73.219999999999999 111.11 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 47.3 t -94.6 -5.68 45.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 71.099999999999994 110.844 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.525 HG23 ' HA ' ' A' ' 66' ' ' TYR . 53.6 t -51.26 121.78 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.117 -0.492 . . . . 75.209999999999994 111.147 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -77.53 75.72 4.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.189 -0.46 . . . . 62.299999999999997 110.864 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.726 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -47.43 -34.16 6.91 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.446 . . . . 62.219999999999999 111.136 -179.853 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -58.71 -44.47 90.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.218 -0.446 . . . . 72.430000000000007 110.898 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -69.09 113.98 6.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.104 -0.498 . . . . 73.129999999999995 110.866 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.22 -23.77 37.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 74.349999999999994 110.884 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -65.78 -54.98 19.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 74.030000000000001 110.872 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLN . . . . . 0.715 ' O ' HD12 ' A' ' 80' ' ' ILE . 0.0 OUTLIER -58.67 -58.23 9.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 73.319999999999993 110.875 -179.942 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -51.61 -31.68 12.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.274 -0.421 . . . . 73.450000000000003 111.171 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 9.2 mtm -68.71 -51.11 45.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.104 -0.498 . . . . 61.119999999999997 110.846 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -56.95 -43.36 81.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.447 . . . . 74.420000000000002 110.86 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.715 HD12 ' O ' ' A' ' 76' ' ' GLN . 1.8 mp -64.43 -53.35 43.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 73.209999999999994 111.15 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.53 HD12 ' HD2' ' A' ' 34' ' ' TYR . 88.5 mt -59.64 -36.65 66.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 72.439999999999998 111.113 179.819 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -71.17 -52.25 20.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 63.43 110.891 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -60.77 -50.84 71.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 65.109999999999999 110.894 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -67.82 -15.07 63.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 75.209999999999994 110.9 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp 57.88 51.82 8.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 71.5 110.923 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.449 HD12 HG12 ' A' ' 81' ' ' ILE . 27.8 mt -77.94 131.5 69.91 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.658 0.742 . . . . 71.349999999999994 111.123 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 152.0 69.29 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.661 2.24 . . . . 73.430000000000007 112.352 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.73 170.24 15.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 75.0 111.188 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 31' ' ' HIS . 95.2 t -52.01 -55.2 10.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.253 -0.43 . . . . 70.310000000000002 111.166 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -51.95 -46.42 64.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.142 -0.481 . . . . 70.340000000000003 110.868 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 58.7 mm-40 -59.68 -42.7 93.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 73.329999999999998 110.936 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 25.3 t90 -64.94 -38.26 90.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 74.439999999999998 110.925 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.86 -49.54 70.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 74.430000000000007 110.923 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -61.65 -45.44 94.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.45 . . . . 73.230000000000004 110.843 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -58.78 -51.67 68.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 74.120000000000005 110.881 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 5.5 p -59.5 -46.01 90.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.156 -0.474 . . . . 73.340000000000003 111.182 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 20.2 mmt180 -57.16 -45.41 83.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.252 -0.431 . . . . 75.349999999999994 110.857 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 33.0 mtp180 -69.45 -32.29 71.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 75.230000000000004 110.888 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -68.51 -37.56 80.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 75.5 110.971 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 61.0 mmtt -81.93 -23.77 35.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.065 -0.516 . . . . 74.219999999999999 110.883 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -93.55 136.31 33.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.256 -0.429 . . . . 74.140000000000001 110.933 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.7 t 63.51 46.57 4.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.476 . . . . 72.400000000000006 110.87 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 16.8 m -62.43 -170.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.092 -0.504 . . . . 53.310000000000002 110.857 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 43.0 mm -51.59 145.84 2.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.124 -0.489 . . . . 71.099999999999994 111.133 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -171.52 -173.35 1.2 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.142 -0.481 . . . . 71.310000000000002 110.867 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.7 mt -111.47 146.26 16.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 74.329999999999998 111.088 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -52.41 137.48 34.13 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.721 -0.752 . . . . 64.219999999999999 112.49 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -91.62 149.78 21.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.842 0.353 . . . . 62.119999999999997 110.895 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -52.39 171.9 0.39 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.724 -0.75 . . . . 51.420000000000002 112.514 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -52.84 -29.32 27.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.82 0.343 . . . . 73.219999999999999 110.856 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -83.55 54.18 4.93 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.727 -0.749 . . . . 42.119999999999997 112.527 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -176.73 122.78 0.15 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.792 0.329 . . . . 73.519999999999996 110.916 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 51.3 m -96.03 143.05 27.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 71.310000000000002 110.866 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 19.4 mp0 -88.9 -74.52 0.46 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 74.519999999999996 110.932 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 86.36 53.78 2.86 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.726 -0.749 . . . . 52.329999999999998 112.474 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.04 175.24 9.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.796 0.331 . . . . 64.319999999999993 110.919 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.469 . . . . 71.319999999999993 110.872 179.949 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 N-CA-C 112.477 -0.249 . . . . 74.030000000000001 112.477 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.46 45.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.873 0.368 . . . . 75.430000000000007 110.888 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -84.04 -76.38 0.3 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 74.549999999999997 110.902 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 22.3 mm 50.51 80.3 0.3 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.661 0.743 . . . . 73.310000000000002 111.138 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 113.49 3.39 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.668 2.245 . . . . 62.329999999999998 112.351 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -123.92 56.6 1.23 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 42.32 110.82 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' -3' ' ' ARG . . . . . 0.4 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 0.1 OUTLIER -109.94 163.59 16.77 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.591 0.71 . . . . 72.200000000000003 110.873 -179.928 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' -2' ' ' PRO . . . . . 0.4 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.4 Cg_endo -69.84 -6.46 18.69 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.655 2.237 . . . . 54.329999999999998 112.359 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 51.47 88.13 0.12 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.554 0.692 . . . . 74.519999999999996 111.105 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.76 126.6 13.5 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.678 2.252 . . . . 42.25 112.371 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 19.2 mtmm -66.34 160.1 67.94 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.532 0.682 . . . . 75.319999999999993 110.931 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 167.32 24.76 Favored 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.719 2.279 . . . . 75.530000000000001 112.372 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 129.47 17.64 Favored 'Trans proline' 0 N--CA 1.466 -0.141 0 C-N-CA 122.719 2.279 . . . . 70.340000000000003 112.322 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 1.7 t -164.04 146.34 9.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 72.349999999999994 110.835 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 3.7 t -68.93 -27.68 65.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.1 -0.5 . . . . 74.010000000000005 110.835 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 74.430000000000007 111.064 179.897 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 2.7 ttt . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.813 0.339 . . . . 73.420000000000002 110.838 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' -1' ' ' ALA . . . . . 0.587 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -92.84 160.35 34.18 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.568 0.699 . . . . 71.420000000000002 111.148 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.587 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.8 Cg_endo -69.76 115.46 4.1 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 122.708 2.272 . . . . 73.430000000000007 112.297 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.9 pp -122.21 134.43 54.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 72.099999999999994 110.942 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -117.45 163.61 16.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 73.310000000000002 110.881 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.429 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -134.93 164.13 28.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 64.549999999999997 111.118 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 24' ' ' GLU . 7.6 p -131.6 131.09 62.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 74.019999999999996 111.148 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.713 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -72.87 136.56 45.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.194 -0.457 . . . . 73.140000000000001 111.137 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.669 HD11 ' HB2' ' A' ' 56' ' ' ARG . 17.4 mt -108.37 -16.07 14.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 73.439999999999998 110.917 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -135.35 161.85 34.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.451 . . . . 53.310000000000002 110.909 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -84.35 105.02 14.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.085 -0.507 . . . . 73.310000000000002 110.895 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -89.61 100.24 13.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 54.539999999999999 110.912 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -80.23 106.85 12.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 74.129999999999995 110.868 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.526 ' HB1' ' HB2' ' A' ' 17' ' ' GLU . . . -58.23 152.83 16.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 73.510000000000005 111.098 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -113.73 -30.97 6.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.242 -0.435 . . . . 73.340000000000003 110.92 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.5 mmp_? -121.21 -179.85 4.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.136 -0.484 . . . . 63.130000000000003 110.906 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -64.12 -39.1 93.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.456 . . . . 62.0 110.844 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -63.11 -50.82 69.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.443 . . . . 71.329999999999998 110.865 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.526 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 55.5 mm-40 -55.07 135.65 48.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 72.349999999999994 110.894 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.7 tp -108.37 136.93 47.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 64.120000000000005 110.907 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -85.18 128.68 34.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 64.230000000000004 110.859 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.713 ' CG1' HG21 ' A' ' 6' ' ' THR . 7.1 p -140.19 143.3 29.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 64.439999999999998 111.127 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -101.81 160.36 26.7 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.688 0.756 . . . . 33.409999999999997 110.836 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 121.79 8.48 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.711 2.274 . . . . 75.349999999999994 112.319 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.12 5.69 30.36 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.701 -0.761 . . . . 72.140000000000001 112.479 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLU . . . . . 0.623 ' O ' HG23 ' A' ' 5' ' ' VAL . 29.5 mt-10 -92.2 169.2 10.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.883 0.373 . . . . 72.409999999999997 110.884 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -113.51 123.33 49.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 74.140000000000001 110.836 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.694 HD11 HG21 ' A' ' 20' ' ' VAL . 4.4 mp -123.18 150.12 43.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.109 -0.496 . . . . 71.230000000000004 110.929 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.94 112.92 26.17 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.175 -0.466 . . . . 63.43 110.832 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.429 HD11 ' HB2' ' A' ' 4' ' ' ALA . 59.6 mt -76.77 145.36 10.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 74.200000000000003 111.17 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.7 m -119.51 -32.6 4.29 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.137 -0.483 . . . . 75.409999999999997 110.874 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.418 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -170.04 174.09 5.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 42.219999999999999 111.08 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.416 ' CG ' HD13 ' A' ' 81' ' ' ILE . 2.7 p80 -123.77 178.02 5.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 64.329999999999998 110.844 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -150.66 104.67 3.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 65.420000000000002 110.912 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 59.93 17.75 6.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.111 -0.495 . . . . 72.340000000000003 110.859 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.61 ' HD2' HD12 ' A' ' 81' ' ' ILE . 24.1 m-85 60.97 20.82 11.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 73.219999999999999 110.902 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -117.68 -24.42 7.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 71.430000000000007 110.912 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.408 ' HB3' HD21 ' A' ' 49' ' ' LEU . 81.3 m95 -132.23 135.81 46.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.107 -0.497 . . . . 75.129999999999995 110.902 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.615 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -118.08 131.99 56.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.202 -0.453 . . . . 74.209999999999994 110.877 -179.937 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.4 mm -89.13 94.74 4.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 53.409999999999997 111.142 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.408 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -115.54 152.34 33.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.457 . . . . 60.049999999999997 111.085 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.0 ptpp? -122.44 157.05 60.05 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.563 0.696 . . . . 72.319999999999993 110.908 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 136.7 33.76 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.683 2.255 . . . . 75.099999999999994 112.372 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 69.1 mt -106.27 -44.1 7.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 64.5 111.155 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' A ASN . . . . . . . . . . . . . 7.9 t-20 -57.11 -74.7 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.157 -0.474 . . . . 72.329999999999998 110.904 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' B ARG . . . . . 0.548 ' O ' HD22 ' A' ' 44' ' ' LEU . 7.6 ptp85 -79.86 -177.26 5.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 63.509999999999998 110.852 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.548 HD22 ' O ' ' A' ' 43' B ARG . 4.0 mm? -123.46 113.63 19.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 64.420000000000002 110.891 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -146.51 -73.42 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.765 -0.731 . . . . 75.219999999999999 112.476 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 166.68 165.48 24.13 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.754 -0.736 . . . . 74.400000000000006 112.496 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 140.4 42.57 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.717 2.278 . . . . 73.439999999999998 112.321 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -129.63 -138.29 4.39 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.753 -0.737 . . . . 52.439999999999998 112.472 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.417 HD12 ' HB3' ' B' ' -7' ' ' PHE . 0.7 OUTLIER -148.46 126.88 12.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.86 0.362 . . . . 72.140000000000001 110.885 -179.901 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.419 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.5 p -136.8 133.45 18.85 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.597 0.713 . . . . 73.140000000000001 111.126 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.419 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.6 Cg_endo -69.77 158.4 57.06 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.665 2.244 . . . . 73.400000000000006 112.349 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.781 HG12 ' HB ' ' A' ' 71' ' ' THR . 6.9 t -70.09 -20.57 23.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 70.310000000000002 111.138 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.9 m -81.24 3.82 22.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 62.219999999999999 110.853 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' TYR . . . . . 0.499 ' O ' HG22 ' A' ' 6' ' ' THR . 17.0 m-85 -131.94 22.1 4.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.474 . . . . 65.319999999999993 110.918 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.412 HG22 ' O ' ' A' ' 51' ' ' PRO . 18.8 m -152.14 160.34 3.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 74.219999999999999 111.163 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.669 ' HB2' HD11 ' A' ' 7' ' ' LEU . 21.4 ttp180 -127.62 120.56 28.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.228 -0.442 . . . . 73.049999999999997 110.89 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.6 mm -71.9 123.03 25.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 62.340000000000003 111.083 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.433 HG23 ' HG2' ' A' ' 56' ' ' ARG . 16.0 pt -141.86 172.07 10.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 71.420000000000002 111.143 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 48.8 t0 -119.42 129.74 54.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.466 . . . . 74.420000000000002 110.883 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 60' ' ' LEU . 16.6 mt -53.57 -27.73 27.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 72.030000000000001 110.908 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.2 mmt -88.01 -31.69 19.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 74.230000000000004 110.864 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -139.44 73.7 35.73 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.596 0.712 . . . . 73.120000000000005 110.863 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.531 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.8 Cg_endo -69.73 -8.58 23.97 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.731 2.288 . . . . 51.119999999999997 112.331 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -103.33 -12.8 17.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 72.319999999999993 111.091 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -75.23 -51.77 12.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.45 . . . . 71.120000000000005 110.906 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.623 ' O ' HG12 ' A' ' 69' ' ' VAL . 61.6 m-85 -96.77 23.13 7.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 73.430000000000007 110.943 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -85.83 -18.64 32.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 74.319999999999993 111.135 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 35.6 t -94.21 -23.42 17.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 62.399999999999999 110.904 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.994 HG21 HD11 ' A' ' 80' ' ' ILE . 7.4 p -51.29 154.83 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.119 -0.492 . . . . 74.219999999999999 111.118 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -107.89 110.24 21.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 61.32 110.853 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.781 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -71.65 -38.88 70.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 75.5 111.145 -179.913 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -55.11 -42.16 72.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.197 -0.456 . . . . 75.030000000000001 110.925 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 52.9 t0 -63.9 105.66 0.88 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 74.140000000000001 110.924 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.01 -29.24 20.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 72.430000000000007 110.845 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -66.98 -56.17 11.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 62.420000000000002 110.862 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -59.1 -55.07 39.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 71.040000000000006 110.905 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.463 ' HA ' HD12 ' A' ' 80' ' ' ILE . 5.4 p -54.24 -32.7 24.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 64.25 111.138 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.3 mtm -67.3 -55.68 12.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 45.450000000000003 110.9 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.8 mttm -55.02 -38.25 67.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.438 . . . . 65.120000000000005 110.883 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.994 HD11 HG21 ' A' ' 69' ' ' VAL . 34.4 mt -65.46 -54.88 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 72.129999999999995 111.132 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.73 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.8 mt -61.0 -36.1 69.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.139 -0.482 . . . . 64.040000000000006 111.149 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -71.03 -47.68 57.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 73.340000000000003 110.861 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -63.03 -52.36 63.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.162 -0.472 . . . . 64.129999999999995 110.88 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -67.87 -15.8 63.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 71.409999999999997 110.866 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.6 mmtm 60.95 62.07 1.51 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.484 . . . . 74.420000000000002 110.944 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.73 ' HB ' HG23 ' A' ' 81' ' ' ILE . 54.7 mt -92.05 132.42 32.6 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.615 0.722 . . . . 52.140000000000001 111.144 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.418 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 53.6 Cg_endo -69.81 169.93 17.84 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.707 2.272 . . . . 73.420000000000002 112.314 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -106.07 177.73 4.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 64.430000000000007 111.115 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.5 t -59.82 -52.79 56.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.204 -0.453 . . . . 71.019999999999996 111.118 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -54.15 -52.65 60.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 60.439999999999998 110.874 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -60.64 -38.78 85.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.156 -0.475 . . . . 73.319999999999993 110.937 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 31.2 t90 -66.45 -37.91 86.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.21 -0.45 . . . . 71.530000000000001 110.879 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.3 mmpt? -66.95 -49.38 65.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.273 -0.422 . . . . 73.140000000000001 110.899 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -61.74 -43.57 98.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 74.5 110.882 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -61.0 -52.91 63.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 73.430000000000007 110.89 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.9 p -59.99 -35.85 75.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 75.310000000000002 111.166 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 2.1 mmt85 -65.53 -54.98 20.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 71.430000000000007 110.887 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 -68.97 -19.48 64.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 73.120000000000005 110.882 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -87.23 -26.89 23.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 71.400000000000006 110.931 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? -87.63 -25.35 23.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.076 -0.511 . . . . 73.420000000000002 110.893 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -51.74 168.57 0.08 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 72.239999999999995 110.914 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 47.1 t -54.42 116.95 2.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 63.219999999999999 110.86 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 97.8 p -143.29 -171.15 3.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.131 -0.486 . . . . 61.140000000000001 110.887 -179.858 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 39.4 mm -53.46 141.13 8.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 75.420000000000002 111.094 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.6 pp0? -174.92 157.29 2.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 64.420000000000002 110.955 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -147.02 101.02 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 64.099999999999994 111.09 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 164.1 -144.73 9.69 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.757 -0.735 . . . . 32.329999999999998 112.475 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 9.3 p-10 -113.65 138.35 50.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.898 0.38 . . . . 53.140000000000001 110.87 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 174.27 -156.09 22.69 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.728 -0.749 . . . . 54.030000000000001 112.496 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 46.9 m80 -142.23 178.93 7.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.803 0.335 . . . . 74.140000000000001 110.851 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -103.57 -166.63 25.43 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.688 -0.768 . . . . 43.130000000000003 112.486 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.5 mp0 -130.38 -174.74 3.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.83 0.348 . . . . 74.540000000000006 110.951 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.5 m -137.38 174.61 10.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.246 -0.434 . . . . 72.340000000000003 110.836 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -104.12 -174.98 2.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.125 -0.488 . . . . 71.340000000000003 110.954 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.577 ' O ' HD12 ' A' ' 116' ' ' LEU . . . -129.54 -90.72 0.61 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.706 -0.759 . . . . 51.32 112.497 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.577 HD12 ' O ' ' A' ' 115' ' ' GLY . 0.4 OUTLIER 33.39 48.16 0.17 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.79 0.329 . . . . 70.209999999999994 110.941 -179.936 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 10.6 tm-20 . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.152 -0.476 . . . . 75.340000000000003 110.897 179.948 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.454 -0.258 . . . . 71.239999999999995 112.454 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 20.0 tttm -133.94 -47.35 0.79 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.79 0.329 . . . . 65.010000000000005 110.899 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' -7' ' ' PHE . . . . . 0.417 ' HB3' HD12 ' A' ' 49' ' ' LEU . 38.2 m-85 -90.08 -71.8 0.6 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 75.340000000000003 110.895 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.6 mm 54.65 77.88 0.42 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.588 0.709 . . . . 71.310000000000002 111.155 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 87.49 0.56 Allowed 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.688 2.258 . . . . 72.329999999999998 112.294 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 33.5 t -104.01 34.17 3.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 55.43 110.859 -179.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' -3' ' ' ARG . . . . . 0.43 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 2.5 mtp85 -95.83 161.07 28.7 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.64 0.733 . . . . 74.030000000000001 110.852 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' -2' ' ' PRO . . . . . 0.43 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.4 Cg_endo -69.73 111.03 2.69 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.671 2.247 . . . . 74.409999999999997 112.342 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' -1' ' ' ALA . . . . . 0.411 ' HA ' ' HD2' ' B' ' 0' ' ' PRO . . . -50.09 108.2 0.96 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.595 0.712 . . . . 73.109999999999999 111.104 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 0' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' B' ' -1' ' ' ALA . 53.6 Cg_endo -69.81 145.69 57.6 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.73 2.287 . . . . 53.219999999999999 112.311 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -97.3 137.49 21.17 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.536 0.684 . . . . 74.109999999999999 110.903 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 165.67 30.21 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.647 2.231 . . . . 72.25 112.379 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 97.77 0.66 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.688 2.259 . . . . 74.230000000000004 112.327 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 72.7 m -77.05 -61.85 1.85 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 72.140000000000001 110.816 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 33.4 t -123.28 89.56 3.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.096 -0.502 . . . . 64.329999999999998 110.863 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 54.210000000000001 111.058 179.94 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 17.2 tpt . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.809 0.338 . . . . 75.230000000000004 110.923 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' -1' ' ' ALA . . . . . 0.548 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -156.65 159.86 31.09 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.55 0.69 . . . . 54.140000000000001 111.084 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.548 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.7 Cg_endo -69.78 75.36 1.23 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.653 2.236 . . . . 75.439999999999998 112.349 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.79 HD11 HG13 ' A' ' 28' ' ' ILE . 0.6 OUTLIER -74.16 140.33 45.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 64.530000000000001 110.938 179.995 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.78 ' CD2' HD22 ' A' ' 60' ' ' LEU . 16.6 m-30 -117.37 139.43 50.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 72.430000000000007 110.858 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -109.7 170.11 8.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 72.140000000000001 111.093 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.95 125.89 58.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 74.310000000000002 111.133 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.745 HG21 ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -71.84 135.45 46.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 65.329999999999998 111.14 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.466 HD11 ' HB2' ' A' ' 56' ' ' ARG . 40.3 mt -105.56 -16.34 14.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.246 -0.434 . . . . 61.439999999999998 110.89 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -138.39 158.3 44.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 74.200000000000003 110.912 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -84.27 104.74 14.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.07 -0.514 . . . . 52.140000000000001 110.875 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -97.17 123.36 40.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 74.099999999999994 110.846 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.73 121.13 40.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 73.099999999999994 110.892 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.58 ' HB1' ' HB3' ' A' ' 17' ' ' GLU . . . -63.46 164.9 8.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.223 -0.444 . . . . 71.239999999999995 111.09 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -116.44 -29.49 6.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.21 -0.45 . . . . 62.130000000000003 110.899 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 -135.89 -176.18 4.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 45.030000000000001 110.828 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -63.5 -43.23 97.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 70.310000000000002 110.858 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.06 -53.15 59.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.466 . . . . 74.430000000000007 110.876 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.58 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 1.9 tp10 -67.42 149.41 50.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.156 -0.474 . . . . 61.119999999999997 110.901 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' LEU . . . . . 0.516 HD22 ' O ' ' A' ' 46' ' ' GLY . 3.1 tp -121.17 154.16 36.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.484 . . . . 70.409999999999997 110.909 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -94.34 148.16 22.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.186 -0.461 . . . . 72.219999999999999 110.862 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.745 ' HB ' HG21 ' A' ' 6' ' ' THR . 0.1 OUTLIER -144.4 159.22 15.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 64.299999999999997 111.133 179.977 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -124.51 157.0 66.79 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.675 0.75 . . . . 71.310000000000002 110.861 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 117.68 5.23 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.726 2.284 . . . . 64.219999999999999 112.309 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.93 5.2 33.42 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.68 -0.771 . . . . 71.230000000000004 112.481 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -91.84 151.67 20.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.819 0.342 . . . . 64.340000000000003 110.905 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -100.69 113.36 26.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 72.519999999999996 110.878 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.702 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 4.1 mp -112.33 168.22 9.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.15 -0.477 . . . . 74.120000000000005 110.949 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.9 t -121.52 116.15 24.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.455 . . . . 43.039999999999999 110.843 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.79 HG13 HD11 ' A' ' 2' ' ' LEU . 27.9 mm -68.55 147.63 12.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 63.340000000000003 111.101 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 27.7 m -125.43 -37.05 2.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 74.140000000000001 110.875 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -170.25 171.76 6.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 52.409999999999997 111.123 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' HIS . . . . . 0.533 ' O ' HG22 ' A' ' 88' ' ' THR . 2.9 p80 -126.44 175.45 7.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.231 -0.44 . . . . 72.230000000000004 110.844 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -147.01 102.17 3.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 74.219999999999999 110.927 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 60.9 18.18 8.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.495 . . . . 64.209999999999994 110.85 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.581 ' CD2' HD12 ' A' ' 81' ' ' ILE . 43.9 m-85 62.1 19.82 11.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.177 -0.465 . . . . 63.530000000000001 110.931 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -119.03 -4.24 10.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.081 -0.509 . . . . 75.129999999999995 110.833 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.432 ' HB3' HD21 ' A' ' 49' ' ' LEU . 79.3 m95 -150.01 135.7 18.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.139 -0.482 . . . . 74.209999999999994 110.878 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.62 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -121.9 144.91 48.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 74.400000000000006 110.842 -179.944 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 11.7 mm -103.51 94.88 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.483 . . . . 75.430000000000007 111.141 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.702 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.19 139.49 45.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 64.140000000000001 111.123 179.777 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 pttp -115.33 157.11 44.73 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.547 0.689 . . . . 64.450000000000003 110.918 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 108.39 2.07 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.664 2.242 . . . . 72.409999999999997 112.328 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.416 HD11 ' CG ' ' A' ' 3' ' ' PHE . 62.3 mt -68.71 -26.88 34.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 70.030000000000001 111.156 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' A ASN . . . . . . . . . . . . . 29.1 m-20 -87.16 -60.86 1.86 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 73.319999999999993 110.895 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' B ARG . . . . . . . . . . . . . 33.0 mtp180 -60.75 -169.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 53.130000000000003 110.86 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 65.0 mt -83.72 -174.46 5.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.217 -0.447 . . . . 64.349999999999994 110.9 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.94 111.32 3.99 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.741 -0.743 . . . . 74.5 112.503 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLY . . . . . 0.516 ' O ' HD22 ' A' ' 18' ' ' LEU . . . -152.03 66.66 0.34 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.726 -0.75 . . . . 64.340000000000003 112.467 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 124.94 11.59 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.708 2.272 . . . . 64.150000000000006 112.331 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -128.85 -136.93 4.24 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.756 -0.735 . . . . 75.239999999999995 112.485 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.507 HD12 ' HB3' ' B' ' -7' ' ' PHE . 1.0 OUTLIER -144.86 126.87 15.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.869 0.366 . . . . 65.120000000000005 110.876 -179.94 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.421 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.3 p -140.53 132.8 14.4 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.617 0.722 . . . . 54.109999999999999 111.107 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.421 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.8 Cg_endo -69.78 151.04 68.84 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.683 2.255 . . . . 75.200000000000003 112.37 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.74 HG12 ' HB ' ' A' ' 71' ' ' THR . 15.9 t -61.97 -21.67 26.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.243 -0.435 . . . . 73.439999999999998 111.133 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.9 t -77.56 -4.11 44.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 34.420000000000002 110.856 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -122.45 15.21 10.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.123 -0.489 . . . . 72.239999999999995 110.92 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.8 m -151.42 156.33 6.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 60.210000000000001 111.084 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.466 ' HB2' HD11 ' A' ' 7' ' ' LEU . 21.1 ttm180 -125.52 124.56 41.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 74.230000000000004 110.865 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.505 HG21 HG21 ' A' ' 80' ' ' ILE . 40.7 mm -74.72 108.98 6.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 73.010000000000005 111.143 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.461 HG23 ' HG2' ' A' ' 56' ' ' ARG . 1.1 pt -126.45 167.93 20.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 73.5 111.176 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -107.89 119.72 40.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.206 -0.452 . . . . 75.239999999999995 110.88 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.78 HD22 ' CD2' ' A' ' 3' ' ' PHE . 0.1 OUTLIER -50.78 -30.83 15.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 65.409999999999997 110.877 -179.93 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.442 ' HE2' ' HG ' ' A' ' 60' ' ' LEU . 2.8 mtm -81.72 -34.75 30.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 64.340000000000003 110.898 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -141.02 76.3 22.46 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.596 0.712 . . . . 75.209999999999994 110.818 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.741 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.3 Cg_endo -69.84 -7.84 22.08 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.707 2.271 . . . . 63.140000000000001 112.303 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.77 -12.37 25.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 55.340000000000003 111.095 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.9 ttmt -84.31 -51.06 7.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.261 -0.427 . . . . 73.150000000000006 110.917 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.552 ' O ' HG12 ' A' ' 69' ' ' VAL . 43.9 m-85 -94.98 23.25 5.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.175 -0.466 . . . . 73.129999999999995 110.935 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.741 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -86.57 -18.16 32.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.103 -0.498 . . . . 75.439999999999998 111.136 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 9.6 p -93.18 -16.07 25.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 71.010000000000005 110.882 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.755 HG21 HD11 ' A' ' 80' ' ' ILE . 9.9 p -51.08 144.36 2.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.118 -0.492 . . . . 72.340000000000003 111.126 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -103.78 86.5 2.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.166 -0.47 . . . . 75.409999999999997 110.844 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.74 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -51.71 -29.95 20.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 75.129999999999995 111.142 -179.887 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -59.41 -47.99 83.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 75.319999999999993 110.905 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -64.05 112.22 2.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 71.409999999999997 110.856 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.66 -26.68 34.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 63.229999999999997 110.877 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -66.33 -49.59 66.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 74.109999999999999 110.921 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 1.8 mm-40 -61.74 -56.07 23.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 74.340000000000003 110.931 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.519 ' HA ' HD12 ' A' ' 80' ' ' ILE . 0.5 OUTLIER -55.69 -30.83 27.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 72.409999999999997 111.134 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.3 mtm -67.83 -56.89 7.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 72.129999999999995 110.876 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 44.4 mttt -57.36 -36.3 71.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 72.540000000000006 110.942 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.755 HD11 HG21 ' A' ' 69' ' ' VAL . 24.7 mt -65.72 -51.38 62.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 65.299999999999997 111.116 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.752 HG23 ' HB ' ' A' ' 86' ' ' ILE . 95.9 mt -61.03 -34.79 61.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.13 -0.486 . . . . 75.450000000000003 111.145 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -71.19 -47.29 58.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.476 . . . . 74.319999999999993 110.858 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -66.47 -45.68 78.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.199 -0.455 . . . . 73.219999999999999 110.927 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -73.98 -10.33 59.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.142 -0.481 . . . . 73.420000000000002 110.839 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.36 44.37 18.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.131 -0.486 . . . . 74.239999999999995 110.935 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.752 ' HB ' HG23 ' A' ' 81' ' ' ILE . 16.1 mt -77.25 120.3 81.0 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.597 0.713 . . . . 73.409999999999997 111.16 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.83 166.63 27.04 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.685 2.257 . . . . 72.109999999999999 112.311 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' THR . . . . . 0.533 HG22 ' O ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -90.66 169.96 10.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 74.310000000000002 111.149 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.7 t -51.42 -57.73 2.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.207 -0.451 . . . . 74.010000000000005 111.138 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -51.35 -44.27 62.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.203 -0.453 . . . . 75.230000000000004 110.887 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 71.0 mm-40 -62.19 -46.26 89.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.13 -0.486 . . . . 71.549999999999997 110.952 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -61.13 -40.13 92.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 72.239999999999995 110.951 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -64.15 -51.68 62.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 72.310000000000002 110.929 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -58.84 -39.5 81.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 65.409999999999997 110.883 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -62.7 -53.58 52.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 74.129999999999995 110.891 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -62.58 -38.73 91.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.446 . . . . 74.340000000000003 111.166 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 24.9 mmt180 -62.44 -59.34 5.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.255 -0.429 . . . . 75.329999999999998 110.867 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 27.4 ptt180 -60.29 -32.39 71.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 62.539999999999999 110.823 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -65.19 -47.04 78.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.216 -0.447 . . . . 73.239999999999995 110.935 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.18 -25.55 68.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 74.439999999999998 110.909 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -104.73 -176.44 3.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.223 -0.444 . . . . 75.099999999999994 110.85 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.1 t -129.68 151.15 50.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.107 -0.497 . . . . 75.030000000000001 110.854 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 61.3 p -124.75 -174.24 2.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.102 -0.499 . . . . 71.519999999999996 110.857 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 23.1 mm -67.8 -21.86 27.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 71.109999999999999 111.165 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -92.42 174.12 7.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 75.299999999999997 110.875 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -147.58 160.68 8.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.22 -0.446 . . . . 73.519999999999996 111.15 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 82.58 167.1 39.94 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.731 -0.747 . . . . 54.240000000000002 112.552 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -113.92 141.27 47.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.94 0.4 . . . . 63.049999999999997 110.868 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -77.06 100.79 1.52 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.703 -0.761 . . . . 74.530000000000001 112.481 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -151.35 136.27 17.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.804 0.335 . . . . 64.420000000000002 110.882 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -135.95 171.53 22.7 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.746 -0.74 . . . . 53.299999999999997 112.542 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -110.42 -179.6 3.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.83 0.348 . . . . 65.230000000000004 110.88 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.5 p -135.91 167.34 21.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 64.230000000000004 110.846 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -165.51 139.05 4.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.078 -0.51 . . . . 72.430000000000007 110.894 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.574 ' C ' HD12 ' A' ' 116' ' ' LEU . . . -133.45 21.64 4.03 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.779 -0.724 . . . . 63.149999999999999 112.493 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.574 HD12 ' C ' ' A' ' 115' ' ' GLY . 1.7 mp 52.15 37.25 21.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.799 0.333 . . . . 65.329999999999998 110.903 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.201 -0.454 . . . . 75.439999999999998 110.892 179.909 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.479 -0.248 . . . . 61.219999999999999 112.479 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.09 6.11 5.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.834 0.349 . . . . 65.120000000000005 110.935 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' -7' ' ' PHE . . . . . 0.507 ' HB3' HD12 ' A' ' 49' ' ' LEU . 39.4 m-85 -95.31 -76.83 0.48 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.44 . . . . 73.430000000000007 110.888 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 12.8 mm 49.1 78.35 0.41 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.577 0.703 . . . . 70.140000000000001 111.165 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 82.37 0.75 Allowed 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.692 2.261 . . . . 72.409999999999997 112.377 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -90.68 47.84 1.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 71.209999999999994 110.88 -179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' -3' ' ' ARG . . . . . 0.433 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 0.2 OUTLIER -105.13 163.21 17.62 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.645 0.736 . . . . 72.230000000000004 110.851 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' -2' ' ' PRO . . . . . 0.433 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.9 Cg_endo -69.76 -5.98 17.5 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.684 2.256 . . . . 73.540000000000006 112.332 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' -1' ' ' ALA . . . . . 0.418 ' HA ' ' HD2' ' B' ' 0' ' ' PRO . . . 51.22 89.4 0.1 OUTLIER Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.543 0.687 . . . . 75.129999999999995 111.094 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 0' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' B' ' -1' ' ' ALA . 54.1 Cg_endo -69.74 129.63 17.95 Favored 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.705 2.27 . . . . 41.32 112.36 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -70.6 160.44 81.65 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.585 0.707 . . . . 63.149999999999999 110.901 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 166.39 27.79 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.693 2.262 . . . . 74.0 112.353 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 115.82 4.27 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.65 2.233 . . . . 63.399999999999999 112.346 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 38.7 t -119.25 58.3 0.87 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.226 -0.443 . . . . 34.109999999999999 110.858 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 19.7 m -53.8 132.79 42.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.083 -0.508 . . . . 65.439999999999998 110.868 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 30.02 111.072 179.908 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 4.7 ppp? . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.778 0.323 . . . . 71.230000000000004 110.902 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' -1' ' ' ALA . . . . . 0.576 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -80.49 160.16 68.0 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.604 0.716 . . . . 73.230000000000004 111.086 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.576 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.5 Cg_endo -69.76 97.43 0.64 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.733 2.289 . . . . 71.150000000000006 112.287 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.5 pp -100.18 139.27 36.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.224 -0.443 . . . . 63.140000000000001 110.899 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -122.47 163.11 20.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.208 -0.451 . . . . 62.009999999999998 110.884 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' ALA . . . . . 0.434 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -135.02 163.39 29.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 41.420000000000002 111.117 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.475 HG12 HG12 ' A' ' 58' ' ' ILE . 7.5 p -127.43 124.95 64.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 51.100000000000001 111.092 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.766 HG21 HG11 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -68.72 145.67 53.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 55.229999999999997 111.117 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.632 HD11 ' HB2' ' A' ' 56' ' ' ARG . 15.7 mt -114.46 -13.74 12.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 74.25 110.857 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -138.33 170.22 16.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 73.140000000000001 110.931 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -92.68 104.92 17.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 73.200000000000003 110.881 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PHE . . . . . 0.497 ' HB3' HG12 ' A' ' 20' ' ' VAL . 26.8 t80 -86.9 104.48 16.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 72.310000000000002 110.868 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.8 mttp -80.92 101.03 9.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.127 -0.488 . . . . 72.439999999999998 110.918 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.15 141.76 17.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 74.109999999999999 111.089 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -111.68 -28.76 7.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.203 -0.453 . . . . 71.510000000000005 110.85 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 34.0 mmt180 -127.11 -178.11 4.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 63.109999999999999 110.854 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -66.95 -37.33 84.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 74.209999999999994 110.888 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -67.91 -30.23 69.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 70.299999999999997 110.856 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -81.6 135.03 35.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 71.540000000000006 110.883 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.9 tp -108.11 150.12 27.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.127 -0.488 . . . . 73.329999999999998 110.921 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -91.73 123.26 34.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 62.409999999999997 110.868 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.838 HG21 HD11 ' A' ' 26' ' ' LEU . 9.2 p -133.09 156.63 42.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.201 -0.454 . . . . 73.409999999999997 111.095 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.93 158.55 40.41 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.709 0.766 . . . . 74.109999999999999 110.808 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 118.71 5.85 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.71 2.273 . . . . 64.140000000000001 112.341 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.04 -1.41 38.21 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.721 -0.752 . . . . 74.510000000000005 112.485 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -83.83 162.24 20.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.828 0.347 . . . . 75.239999999999995 110.92 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASN . . . . . 0.418 ' CB ' HD12 ' A' ' 42' ' ' ILE . 6.4 m120 -100.76 132.32 46.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 75.420000000000002 110.847 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.838 HD11 HG21 ' A' ' 20' ' ' VAL . 15.2 mt -129.47 151.71 49.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.106 -0.497 . . . . 74.120000000000005 110.902 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.69 112.82 25.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 74.319999999999993 110.908 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.434 HD11 ' HB2' ' A' ' 4' ' ' ALA . 56.3 mt -80.67 144.44 10.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.141 -0.481 . . . . 75.409999999999997 111.139 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.5 m -117.11 -39.96 3.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.193 -0.458 . . . . 45.520000000000003 110.856 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.543 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -163.28 173.76 12.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.202 -0.454 . . . . 52.32 111.056 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -119.97 177.96 4.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 73.439999999999998 110.819 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.716 ' CE2' HG23 ' B' ' -6' ' ' ILE . 49.8 t80 -148.2 101.17 3.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 71.140000000000001 110.912 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 60.15 18.05 7.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 53.450000000000003 110.862 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.611 ' HD2' HD12 ' A' ' 81' ' ' ILE . 39.1 m-85 61.61 20.62 11.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.23 -0.441 . . . . 75.019999999999996 110.925 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -118.25 -9.33 10.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.11 -0.496 . . . . 51.310000000000002 110.879 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.411 ' HB3' HD21 ' A' ' 49' ' ' LEU . 80.6 m95 -149.23 135.81 19.44 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.15 -0.477 . . . . 74.329999999999998 110.944 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.642 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -116.45 130.23 56.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.237 -0.438 . . . . 75.150000000000006 110.907 -179.964 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.7 mm -83.54 95.1 3.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 61.420000000000002 111.136 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.559 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.87 149.61 30.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 42.43 111.114 179.805 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 pttp -125.04 157.22 67.7 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.555 0.693 . . . . 72.340000000000003 110.935 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 135.97 31.7 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.642 2.228 . . . . 74.439999999999998 112.335 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.418 HD12 ' CB ' ' A' ' 25' ' ' ASN . 57.2 mt -98.69 -22.98 4.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 71.129999999999995 111.167 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' A ASN . . . . . . . . . . . . . 2.6 m120 -88.39 -69.64 0.69 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.139 -0.482 . . . . 71.219999999999999 110.897 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' B ARG . . . . . . . . . . . . . 10.9 ptp180 -66.15 162.65 19.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 74.439999999999998 110.875 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.49 13.9 29.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 73.519999999999996 110.899 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -51.17 -88.0 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.714 -0.755 . . . . 60.32 112.484 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 176.5 170.7 39.41 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.715 -0.755 . . . . 33.210000000000001 112.481 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 148.81 65.71 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.647 2.231 . . . . 63.329999999999998 112.318 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.5 -141.93 4.55 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.705 -0.76 . . . . 65.209999999999994 112.485 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.602 HD11 ' HD3' ' B' ' -5' ' ' PRO . 0.7 OUTLIER -146.24 131.26 18.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.828 0.347 . . . . 44.43 110.939 -179.941 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.435 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.5 p -142.41 133.58 12.93 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.606 0.717 . . . . 72.340000000000003 111.196 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.435 ' HD2' HG23 ' A' ' 50' ' ' VAL . 54.0 Cg_endo -69.76 152.69 69.39 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.649 2.233 . . . . 74.109999999999999 112.309 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.793 HG12 ' HB ' ' A' ' 71' ' ' THR . 13.1 t -64.85 -21.75 30.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.467 . . . . 70.109999999999999 111.145 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.4 t -77.09 -3.07 37.37 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.474 . . . . 74.340000000000003 110.863 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -125.09 18.22 8.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 63.439999999999998 110.878 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.583 HG22 ' HA ' ' A' ' 52' ' ' VAL . 13.6 m -148.96 159.86 5.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 72.519999999999996 111.077 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.632 ' HB2' HD11 ' A' ' 7' ' ' LEU . 18.4 ttm180 -127.28 112.31 14.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 75.439999999999998 110.894 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 35.2 mm -64.66 114.14 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.459 . . . . 73.519999999999996 111.11 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.509 HG23 ' HG2' ' A' ' 56' ' ' ARG . 1.5 pt -133.52 137.69 52.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 74.140000000000001 111.177 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -75.13 122.23 23.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.163 -0.471 . . . . 75.439999999999998 110.877 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.4 mt -52.02 -32.79 35.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 73.209999999999994 110.93 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 8.5 mmt -83.06 -29.16 29.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.474 . . . . 75.5 110.845 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -145.3 78.95 11.91 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 121.618 0.723 . . . . 75.030000000000001 110.905 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.752 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.4 Cg_endo -69.78 -7.73 21.82 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.678 2.252 . . . . 73.109999999999999 112.306 -179.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.15 -7.89 37.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.258 -0.428 . . . . 63.329999999999998 111.123 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.4 mtpt -84.12 -52.11 6.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 63.420000000000002 110.9 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.615 ' O ' HG12 ' A' ' 69' ' ' VAL . 12.7 m-85 -97.64 23.73 7.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.204 -0.453 . . . . 74.319999999999993 110.941 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.752 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -84.88 -17.06 39.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.088 -0.505 . . . . 33.420000000000002 111.053 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 38.0 m -97.87 -18.36 18.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 61.229999999999997 110.856 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.896 HG21 HD11 ' A' ' 80' ' ' ILE . 7.3 p -51.2 144.84 2.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.105 -0.498 . . . . 75.109999999999999 111.127 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -99.14 87.28 3.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.133 -0.485 . . . . 60.32 110.908 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.793 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -51.92 -34.62 42.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.452 . . . . 73.219999999999999 111.203 -179.875 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -58.22 -45.02 88.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 75.129999999999995 110.937 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -63.5 109.14 1.54 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.115 -0.493 . . . . 73.519999999999996 110.921 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.61 -26.24 31.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 60.109999999999999 110.868 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -67.01 -52.85 37.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 73.129999999999995 110.895 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -60.99 -56.42 21.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 72.409999999999997 110.931 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.576 HG21 HG11 ' A' ' 52' ' ' VAL . 1.5 p -53.7 -31.49 20.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.464 . . . . 73.299999999999997 111.135 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 12.3 mtm -68.06 -56.54 8.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.461 . . . . 75.219999999999999 110.86 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.1 mttt -55.05 -37.42 66.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.19 -0.459 . . . . 75.420000000000002 110.891 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.896 HD11 HG21 ' A' ' 69' ' ' VAL . 48.0 mt -66.32 -52.67 44.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.431 . . . . 73.409999999999997 111.157 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.733 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.5 mt -61.96 -35.8 70.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 72.310000000000002 111.133 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -69.9 -47.66 61.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.139 -0.482 . . . . 45.219999999999999 110.853 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -64.25 -49.25 72.65 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 75.540000000000006 110.883 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -68.04 -14.71 63.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 73.329999999999998 110.907 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.5 mmtp 60.46 55.81 3.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 72.420000000000002 110.941 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.733 ' HB ' HG23 ' A' ' 81' ' ' ILE . 31.4 mt -88.41 126.09 61.45 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.623 0.725 . . . . 70.299999999999997 111.159 179.848 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.543 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 54.1 Cg_endo -69.73 163.8 36.9 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.709 2.273 . . . . 64.040000000000006 112.361 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.95 172.11 8.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 62.200000000000003 111.132 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' VAL . . . . . 0.413 HG23 ' HB2' ' A' ' 32' ' ' TYR . 88.2 t -51.34 -54.31 12.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.451 . . . . 74.319999999999993 111.117 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -50.5 -47.5 57.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 73.349999999999994 110.888 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 45.4 mm-40 -62.96 -41.89 99.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.096 -0.502 . . . . 72.120000000000005 110.899 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 24.2 t90 -65.19 -39.99 93.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.2 -0.454 . . . . 74.230000000000004 110.94 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.82 -49.54 70.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.276 -0.42 . . . . 70.510000000000005 110.916 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -63.16 -37.73 88.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 71.129999999999995 110.89 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -63.49 -52.04 63.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 73.239999999999995 110.915 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -60.98 -43.89 98.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.171 -0.468 . . . . 72.340000000000003 111.117 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 8.9 mmt-85 -58.34 -57.69 11.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 73.329999999999998 110.868 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 29.7 ptt180 -62.72 -28.43 69.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 72.120000000000005 110.892 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -66.61 -45.97 77.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.219 -0.446 . . . . 75.439999999999998 110.873 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.1 mtpp -57.23 -25.78 59.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.141 -0.481 . . . . 73.129999999999995 110.91 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -65.8 -172.52 0.13 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 54.340000000000003 110.846 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 55.81 36.04 26.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.11 -0.495 . . . . 53.409999999999997 110.858 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 63.1 m -61.13 129.6 42.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.102 -0.499 . . . . 64.310000000000002 110.876 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' ILE . . . . . 0.58 ' O ' HG22 ' A' ' 104' ' ' ILE . 16.7 mt 69.62 21.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.458 . . . . 64.319999999999993 111.101 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -128.6 -169.61 2.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 70.230000000000004 110.94 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.3 mp -130.16 -63.97 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.233 -0.44 . . . . 74.25 111.11 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 78.11 -139.22 22.37 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.731 -0.747 . . . . 62.219999999999999 112.51 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -111.32 146.38 37.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.877 0.37 . . . . 71.340000000000003 110.925 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 154.51 -30.74 0.69 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.77 -0.729 . . . . 73.040000000000006 112.519 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -81.42 -43.66 18.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.893 0.378 . . . . 72.099999999999994 110.855 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 67.29 -138.87 34.86 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.744 -0.741 . . . . 51.399999999999999 112.474 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -134.89 169.19 17.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.776 0.322 . . . . 71.329999999999998 110.945 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 12.9 m -110.37 -176.96 3.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 61.399999999999999 110.853 -179.769 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 23.0 mm100 -87.9 -65.95 0.96 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.495 . . . . 74.129999999999995 110.908 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 72.67 100.55 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.771 -0.728 . . . . 42.509999999999998 112.515 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 63.9 mt -94.93 -176.75 3.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.768 0.318 . . . . 72.430000000000007 110.938 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.195 -0.457 . . . . 65.349999999999994 110.842 179.954 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 N-CA-C 112.46 -0.256 . . . . 75.019999999999996 112.46 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.41 -61.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.808 0.337 . . . . 62.210000000000001 110.919 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -85.64 -80.25 0.22 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.466 . . . . 65.519999999999996 110.87 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' -6' ' ' ILE . . . . . 0.716 HG23 ' CE2' ' A' ' 32' ' ' TYR . 58.1 mt 45.46 84.47 0.19 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.638 0.732 . . . . 75.319999999999993 111.099 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' -5' ' ' PRO . . . . . 0.602 ' HD3' HD11 ' A' ' 49' ' ' LEU . 53.8 Cg_endo -69.79 127.51 14.67 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.666 2.244 . . . . 64.209999999999994 112.339 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -114.03 0.73 14.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.239 -0.437 . . . . 75.510000000000005 110.874 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -50.63 163.82 0.45 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.635 0.731 . . . . 64.129999999999995 110.849 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -16.22 37.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.651 2.234 . . . . 53.100000000000001 112.377 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.1 84.65 0.18 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.549 0.69 . . . . 70.329999999999998 111.12 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 138.02 36.94 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.679 2.253 . . . . 65.420000000000002 112.351 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -71.4 160.69 81.81 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.572 0.701 . . . . 73.310000000000002 110.895 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 167.6 24.0 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.635 2.223 . . . . 64.549999999999997 112.33 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 -25.32 28.88 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.66 2.24 . . . . 65.510000000000005 112.382 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 50.0 m -80.32 68.34 6.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 75.140000000000001 110.847 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 49.2 m -104.21 -40.43 6.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.114 -0.493 . . . . 61.43 110.85 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.123 -0.49 . . . . 64.439999999999998 111.107 179.914 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.79 0.329 . . . . 72.319999999999993 110.853 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' -1' ' ' ALA . . . . . 0.569 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -133.96 160.43 68.58 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.596 0.712 . . . . 63.210000000000001 111.08 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 1' ' ' PRO . . . . . 0.569 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 54.1 Cg_endo -69.87 119.82 6.69 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.662 2.241 . . . . 74.329999999999998 112.355 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 2' ' ' LEU . . . . . 0.649 HD11 HG13 ' A' ' 28' ' ' ILE . 0.5 OUTLIER -117.49 156.18 28.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 75.129999999999995 110.907 -179.987 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.699 ' CG ' HD23 ' A' ' 60' ' ' LEU . 50.1 m-85 -129.8 161.49 30.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 71.010000000000005 110.874 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -136.39 161.64 35.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 72.299999999999997 111.09 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.463 HG12 HG12 ' A' ' 58' ' ' ILE . 8.7 p -130.76 128.07 62.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.466 . . . . 64.310000000000002 111.104 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.734 HG21 HG11 ' A' ' 20' ' ' VAL . 0.6 OUTLIER -74.32 139.63 44.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.173 -0.467 . . . . 73.200000000000003 111.153 179.988 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.792 HD11 ' HB2' ' A' ' 56' ' ' ARG . 9.9 mt -114.9 -15.4 11.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 75.0 110.866 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -135.07 158.2 44.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 74.310000000000002 110.918 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -84.38 105.14 14.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.088 -0.506 . . . . 74.400000000000006 110.878 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -88.31 117.98 27.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 71.409999999999997 110.915 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.7 mttt -93.47 113.18 25.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 71.530000000000001 110.845 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.687 ' HB1' ' HB2' ' A' ' 17' ' ' GLU . . . -66.36 156.71 33.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 73.510000000000005 111.099 179.78 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -115.66 -28.55 6.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 73.099999999999994 110.867 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.6 mmm180 -133.09 174.55 10.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 74.530000000000001 110.856 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -58.85 -40.99 85.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 73.329999999999998 110.877 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -60.32 -25.89 66.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.172 -0.467 . . . . 71.310000000000002 110.871 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.687 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 5.9 mm-40 -87.62 139.41 30.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.452 . . . . 74.200000000000003 110.908 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tp -116.11 123.27 47.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.182 -0.463 . . . . 44.030000000000001 110.913 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -74.26 145.73 43.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.184 -0.462 . . . . 71.140000000000001 110.874 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.774 HG21 HD11 ' A' ' 26' ' ' LEU . 9.9 p -147.35 156.78 10.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.232 -0.44 . . . . 72.329999999999998 111.136 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -113.2 158.45 38.11 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.649 0.738 . . . . 63.450000000000003 110.855 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 125.32 12.02 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.681 2.254 . . . . 62.520000000000003 112.358 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.16 -6.84 32.49 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.717 -0.754 . . . . 63.43 112.496 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -87.74 143.99 26.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.855 0.36 . . . . 70.340000000000003 110.882 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -97.07 120.56 37.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 65.319999999999993 110.915 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' LEU . . . . . 0.774 HD11 HG21 ' A' ' 20' ' ' VAL . 2.9 mp -111.89 157.44 20.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 72.219999999999999 110.873 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.33 112.85 25.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 74.409999999999997 110.836 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ILE . . . . . 0.649 HG13 HD11 ' A' ' 2' ' ' LEU . 29.7 mm -69.68 143.5 14.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 73.420000000000002 111.097 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.5 m -121.4 -39.7 2.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.15 -0.477 . . . . 74.219999999999999 110.925 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.416 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -173.89 173.43 3.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.474 . . . . 72.010000000000005 111.105 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -120.87 176.19 5.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 63.409999999999997 110.876 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' TYR . . . . . 0.747 ' OH ' HG23 ' B' ' -6' ' ' ILE . 29.7 t80 -146.59 101.01 3.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.198 -0.455 . . . . 72.109999999999999 110.941 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ASP . . . . . 0.42 ' HB3' ' CG ' ' A' ' 35' ' ' GLU . 38.0 t0 61.44 16.45 7.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 64.530000000000001 110.903 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.613 ' HD2' HD12 ' A' ' 81' ' ' ILE . 40.6 m-85 63.76 30.06 14.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 72.140000000000001 110.908 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.42 ' CG ' ' HB3' ' A' ' 33' ' ' ASP . 3.6 pt-20 -132.21 -1.57 3.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.158 -0.474 . . . . 72.439999999999998 110.906 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.556 ' HB3' HD21 ' A' ' 49' ' ' LEU . 85.5 m95 -152.75 135.46 15.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.155 -0.475 . . . . 74.420000000000002 110.938 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PHE . . . . . 0.527 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -121.72 139.0 54.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.289 -0.414 . . . . 72.209999999999994 110.886 -179.991 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 12.9 mm -93.31 94.79 4.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.126 -0.488 . . . . 72.129999999999995 111.131 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ALA . . . . . 0.765 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -108.75 134.87 50.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.466 . . . . 75.219999999999999 111.135 179.801 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.64 156.53 39.52 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.555 0.693 . . . . 74.299999999999997 110.914 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 124.17 10.84 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.691 2.261 . . . . 75.239999999999995 112.33 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 46.8 mt -90.19 -45.2 15.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.276 -0.42 . . . . 65.099999999999994 111.102 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' A ASN . . . . . . . . . . . . . 18.3 t-20 -74.69 -67.89 0.59 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 73.420000000000002 110.888 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' B ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.01 170.64 16.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.443 . . . . 73.239999999999995 110.886 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.42 -176.43 3.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 63.530000000000001 110.885 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 137.48 -93.89 0.22 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.723 -0.751 . . . . 72.040000000000006 112.478 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -177.88 165.71 35.44 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.751 -0.738 . . . . 64.430000000000007 112.511 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 144.32 53.38 Favored 'Trans proline' 0 C--N 1.341 0.134 0 C-N-CA 122.683 2.255 . . . . 72.450000000000003 112.312 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.22 -158.01 8.38 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.752 -0.737 . . . . 64.430000000000007 112.55 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.556 HD21 ' HB3' ' A' ' 36' ' ' TRP . 1.0 OUTLIER -124.92 125.01 43.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.89 0.376 . . . . 71.209999999999994 110.915 -179.933 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 50' ' ' VAL . . . . . 0.5 HG11 ' HB3' ' A' ' 39' ' ' ALA . 7.4 p -131.11 133.74 25.03 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-O 121.626 0.727 . . . . 71.200000000000003 111.12 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' PRO . . . . . 0.461 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.9 Cg_endo -69.73 153.19 69.36 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.669 2.246 . . . . 72.439999999999998 112.365 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.814 HG12 ' HB ' ' A' ' 71' ' ' THR . 4.6 t -74.39 -21.14 17.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 71.349999999999994 111.151 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.9 m -76.59 -3.28 36.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 74.420000000000002 110.852 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -125.97 21.29 7.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.148 -0.478 . . . . 73.420000000000002 110.946 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' VAL . . . . . 0.625 HG22 ' HA ' ' A' ' 52' ' ' VAL . 10.4 m -148.87 167.0 3.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.086 -0.506 . . . . 52.539999999999999 111.146 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.792 ' HB2' HD11 ' A' ' 7' ' ' LEU . 39.8 ttm-85 -138.35 119.68 14.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 64.040000000000006 110.811 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 38.8 mm -70.29 108.8 2.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.183 -0.462 . . . . 64.409999999999997 111.154 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ILE . . . . . 0.497 HG23 ' HG2' ' A' ' 56' ' ' ARG . 2.2 pt -128.31 140.3 49.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.459 . . . . 72.420000000000002 111.122 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -78.76 121.91 25.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.187 -0.46 . . . . 74.530000000000001 110.848 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.699 HD23 ' CG ' ' A' ' 3' ' ' PHE . 0.2 OUTLIER -53.5 -30.02 39.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.157 -0.474 . . . . 72.230000000000004 110.892 -179.976 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.404 ' HE3' ' HB3' ' A' ' 60' ' ' LEU . 14.3 mmt -85.36 -26.07 26.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 73.439999999999998 110.865 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -148.95 77.72 9.14 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.665 0.745 . . . . 64.409999999999997 110.884 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' PRO . . . . . 0.737 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 54.1 Cg_endo -69.7 -7.95 22.35 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.696 2.264 . . . . 72.200000000000003 112.376 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.42 -5.98 45.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.203 -0.453 . . . . 71.310000000000002 111.15 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -84.03 -41.49 17.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 65.420000000000002 110.867 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' TYR . . . . . 0.677 ' O ' HG12 ' A' ' 69' ' ' VAL . 23.4 m-85 -111.72 23.67 13.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.213 -0.449 . . . . 73.200000000000003 110.957 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ALA . . . . . 0.737 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -81.34 -13.4 58.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.09 -0.505 . . . . 73.230000000000004 111.13 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.4 t -102.85 -22.22 13.91 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 64.150000000000006 110.825 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' VAL . . . . . 0.943 HG21 HD11 ' A' ' 80' ' ' ILE . 9.9 p -51.18 156.61 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.108 -0.496 . . . . 73.25 111.097 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -114.25 107.43 15.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 65.530000000000001 110.867 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.814 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -70.8 -25.8 63.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.153 -0.476 . . . . 42.219999999999999 111.145 -179.879 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -62.97 -47.67 82.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.225 -0.443 . . . . 72.329999999999998 110.918 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -63.83 110.16 1.99 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.136 -0.484 . . . . 65.299999999999997 110.87 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.31 -27.61 24.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 73.25 110.855 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -66.96 -54.36 22.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.445 . . . . 52.049999999999997 110.87 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -59.77 -55.75 30.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 74.340000000000003 110.878 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' VAL . . . . . 0.528 ' HA ' HD12 ' A' ' 80' ' ' ILE . 5.4 p -54.05 -32.81 23.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.209 -0.451 . . . . 62.539999999999999 111.168 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 15.0 mtm -67.15 -53.83 26.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.128 -0.487 . . . . 74.310000000000002 110.872 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.0 mttm -56.52 -38.37 71.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 74.209999999999994 110.891 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.943 HD11 HG21 ' A' ' 69' ' ' VAL . 16.5 mt -65.29 -52.95 45.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.456 . . . . 65.319999999999993 111.088 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 81' ' ' ILE . . . . . 0.788 HG23 ' HB ' ' A' ' 86' ' ' ILE . 94.7 mt -62.01 -36.48 74.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 64.510000000000005 111.151 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -70.19 -46.78 63.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.147 -0.479 . . . . 72.310000000000002 110.804 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -63.53 -53.64 48.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 61.210000000000001 110.878 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.2 m-85 -68.03 -14.8 63.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.132 -0.486 . . . . 74.329999999999998 110.85 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 28.6 mmtm 60.78 55.49 3.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 72.129999999999995 110.93 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' ILE . . . . . 0.788 ' HB ' HG23 ' A' ' 81' ' ' ILE . 36.0 mt -82.5 131.98 53.72 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.601 0.715 . . . . 64.540000000000006 111.193 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 87' ' ' PRO . . . . . 0.416 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 53.4 Cg_endo -69.78 166.94 25.93 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.665 2.244 . . . . 65.540000000000006 112.316 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -97.33 168.01 10.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 73.310000000000002 111.154 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.2 t -51.41 -54.91 9.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 74.519999999999996 111.129 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -51.65 -52.06 50.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 74.120000000000005 110.846 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -57.02 -42.44 80.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 72.439999999999998 110.898 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -62.2 -39.39 92.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.218 -0.446 . . . . 74.329999999999998 110.932 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -65.12 -53.37 46.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.223 -0.444 . . . . 75.150000000000006 110.868 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -59.06 -37.23 76.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 43.409999999999997 110.872 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -64.4 -54.42 33.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 75.319999999999993 110.94 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.2 p -60.27 -44.17 95.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.208 -0.451 . . . . 70.530000000000001 111.171 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -57.99 -58.94 6.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.224 -0.444 . . . . 74.030000000000001 110.872 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -57.04 -37.03 71.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.226 -0.443 . . . . 70.340000000000003 110.881 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -61.87 -44.88 95.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 71.0 110.895 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp -76.94 -25.57 53.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.091 -0.504 . . . . 74.409999999999997 110.935 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -70.67 -177.46 1.55 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.43 . . . . 74.540000000000006 110.875 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 8.6 t 62.53 40.91 10.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.123 -0.489 . . . . 72.099999999999994 110.879 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 13.9 m -113.78 163.7 14.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.081 -0.509 . . . . 64.120000000000005 110.836 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 2.3 mt -58.94 134.07 24.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.112 -0.494 . . . . 75.150000000000006 111.137 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 105' ' ' GLN . . . . . 0.557 ' O ' HD13 ' A' ' 106' ' ' ILE . 2.7 mt-30 -179.43 165.18 1.38 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.162 -0.472 . . . . 65.430000000000007 110.846 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 106' ' ' ILE . . . . . 0.557 HD13 ' O ' ' A' ' 105' ' ' GLN . 44.6 mm -132.29 112.33 19.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 71.349999999999994 111.151 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 166.57 96.61 0.11 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.729 -0.748 . . . . 65.109999999999999 112.495 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 5.3 p-10 -85.61 147.99 26.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.857 0.361 . . . . 62.439999999999998 110.858 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -177.46 52.36 0.1 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.731 -0.747 . . . . 75.230000000000004 112.512 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -115.63 167.35 10.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.823 0.344 . . . . 73.209999999999994 110.872 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -168.64 -156.85 10.77 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.72 -0.752 . . . . 64.099999999999994 112.488 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 73.2 mm-40 -82.37 154.94 24.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.791 0.329 . . . . 73.099999999999994 110.917 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.3 p -83.52 -68.56 0.7 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.205 -0.452 . . . . 64.239999999999995 110.841 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -143.7 155.91 44.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 74.329999999999998 110.924 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 115' ' ' GLY . . . . . 0.616 ' O ' HD12 ' A' ' 116' ' ' LEU . . . -112.36 -19.92 6.87 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.698 -0.763 . . . . 64.299999999999997 112.487 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 116' ' ' LEU . . . . . 0.616 HD12 ' O ' ' A' ' 115' ' ' GLY . 0.4 OUTLIER 33.01 49.87 0.2 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.784 0.326 . . . . 71.140000000000001 110.957 -179.88 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 64.340000000000003 110.857 179.959 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 N-CA-C 112.498 -0.241 . . . . 75.010000000000005 112.498 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 1.4 mppp? -120.02 -32.32 4.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.796 0.331 . . . . 73.510000000000005 110.902 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -75.94 -74.89 0.2 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 74.019999999999996 110.886 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' -6' ' ' ILE . . . . . 0.747 HG23 ' OH ' ' A' ' 32' ' ' TYR . 3.9 mp 51.67 82.02 0.25 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.579 0.704 . . . . 71.25 111.163 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.71 117.88 5.35 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.649 2.232 . . . . 74.140000000000001 112.388 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 30.5 t -107.02 5.06 27.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.246 -0.433 . . . . 64.510000000000005 110.84 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 2.0 mpp_? -51.62 162.72 0.69 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.567 0.698 . . . . 73.140000000000001 110.888 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 -11.19 30.31 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.642 2.228 . . . . 71.109999999999999 112.32 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 63.82 82.3 0.21 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.611 0.719 . . . . 73.310000000000002 111.083 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 141.18 44.47 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.663 2.242 . . . . 73.239999999999995 112.332 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 22.1 mtmm -86.81 159.61 51.66 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.578 0.704 . . . . 65.099999999999994 110.89 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 166.9 26.04 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.658 2.239 . . . . 74.430000000000007 112.383 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 99.53 0.75 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.696 2.264 . . . . 73.219999999999999 112.343 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 2.0 m -93.03 166.59 12.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 65.239999999999995 110.819 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 32.8 p -159.13 138.56 11.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 73.219999999999999 110.856 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 71.230000000000004 111.081 179.891 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.738 HD11 HG13 ' A' ' 28' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.103 0 CA-C-O 120.805 0.336 . . . . 74.15 110.926 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.475 ' CE1' HD11 ' A' ' 60' ' ' LEU . 20.5 m-85 -133.22 146.11 51.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 73.41 110.949 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -122.56 153.47 39.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.187 -0.46 . . . . 61.0 111.103 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 24' ' ' GLU . 7.5 p -123.27 130.22 74.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.21 -0.45 . . . . 65.31 111.118 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.58 HG21 ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -72.26 138.17 47.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 52.23 111.182 -179.98 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.725 HD11 ' HB2' ' A' ' 56' ' ' ARG . 13.4 mt -112.44 -12.02 13.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.254 -0.43 . . . . 74.23 110.95 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -137.69 154.81 49.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.185 -0.461 . . . . 74.23 110.931 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -81.94 104.73 12.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.127 -0.488 . . . . 71.41 110.893 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -109.61 102.87 11.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 73.31 110.845 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -78.99 136.32 37.18 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 70.12 110.88 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.32 161.2 11.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 63.13 111.102 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -124.6 -36.47 2.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 44.12 110.936 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -132.45 -177.88 4.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 74.32 110.886 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -65.67 -15.12 62.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.221 -0.445 . . . . 74.0 110.886 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -99.03 22.34 10.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 64.43 110.878 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.0 mp0 -136.87 142.85 42.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 73.35 110.843 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.5 tp -121.36 126.45 49.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.145 -0.48 . . . . 61.44 110.946 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -65.5 139.96 58.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.457 . . . . 73.44 110.83 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.58 ' HB ' HG21 ' A' ' 6' ' ' THR . 0.4 OUTLIER -142.47 158.44 19.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 63.41 111.17 179.965 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -127.17 159.85 62.87 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.649 0.738 . . . . 61.31 110.83 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 117.78 5.29 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.659 2.239 . . . . 72.24 112.373 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.5 7.12 30.47 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.718 -0.753 . . . . 44.45 112.448 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.557 ' O ' HG23 ' A' ' 5' ' ' VAL . 22.2 mm-40 -91.91 162.49 14.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.857 0.36 . . . . 74.13 110.908 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -107.96 119.42 39.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 74.04 110.897 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.778 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 5.5 mt -120.98 154.29 36.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.195 -0.457 . . . . 73.25 110.946 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -109.03 115.94 31.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 65.33 110.844 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.738 HG13 HD11 ' A' ' 2' ' ' LEU . 35.4 mm -70.57 143.32 14.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.476 . . . . 53.53 111.149 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.9 m -124.5 -37.13 2.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 71.23 110.887 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -168.87 170.62 9.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 40.54 111.093 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -123.89 174.51 7.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 73.34 110.873 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -142.16 100.68 3.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 75.24 110.896 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 60.09 18.78 8.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.075 -0.511 . . . . 63.44 110.87 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.616 ' HD2' HD12 ' A' ' 81' ' ' ILE . 36.4 m-85 65.45 23.95 11.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.218 -0.446 . . . . 75.15 110.942 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.492 ' O ' HG23 ' A' ' 52' ' ' VAL . 0.4 OUTLIER -116.92 -41.31 3.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.098 -0.501 . . . . 74.3 110.866 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.426 ' CD1' ' HB2' ' A' ' 35' ' ' GLU . 56.6 m95 -116.62 140.32 49.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.185 -0.461 . . . . 74.44 110.926 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.613 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -119.31 142.8 47.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 52.13 110.873 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 23.5 mm -96.27 95.44 4.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 71.55 111.103 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.778 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -109.06 136.38 48.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 60.41 111.099 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.8 pttt -111.46 157.73 38.31 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.621 0.724 . . . . 74.23 110.908 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 135.53 30.58 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.701 2.268 . . . . 64.41 112.367 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 79.3 mt . . . . . 0 C--N 1.329 -0.304 0 CA-C-N 116.26 -0.427 . . . . 75.52 111.152 179.923 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo . . . . . 0 N--CA 1.466 -0.133 0 CA-C-O 120.806 0.253 . . . . 73.3 112.327 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.22 -143.29 4.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.771 -0.728 . . . . 54.14 112.504 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.412 HD11 ' HD3' ' B' ' -5' ' ' PRO . 0.2 OUTLIER -146.17 124.86 12.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.893 0.378 . . . . 61.1 110.899 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.442 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.3 p -136.18 133.87 19.82 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.635 0.731 . . . . 74.22 111.14 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.442 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.8 Cg_endo -69.76 153.18 69.22 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.664 2.243 . . . . 72.24 112.352 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.782 HG12 ' HB ' ' A' ' 71' ' ' THR . 11.1 t -66.34 -21.74 29.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.245 -0.434 . . . . 72.22 111.164 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.1 m -77.94 -1.93 34.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.154 -0.475 . . . . 72.31 110.871 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -126.84 22.91 6.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.137 -0.483 . . . . 73.11 110.934 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.559 HG22 ' HA ' ' A' ' 52' ' ' VAL . 16.8 m -150.23 165.18 3.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.1 -0.5 . . . . 74.51 111.181 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.725 ' HB2' HD11 ' A' ' 7' ' ' LEU . 40.0 ttp85 -133.5 114.02 13.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.233 -0.44 . . . . 74.51 110.865 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 29.1 mm -69.37 127.34 31.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 74.32 111.129 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.444 HG21 ' NH1' ' A' ' 56' ' ' ARG . 24.7 pt -143.49 -178.22 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 73.41 111.132 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -131.44 132.67 44.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.467 . . . . 62.12 110.838 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.475 HD11 ' CE1' ' A' ' 3' ' ' PHE . 57.6 mt -59.28 -21.84 60.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 73.43 110.974 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.1 mtm -90.04 -30.21 17.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.14 -0.482 . . . . 74.22 110.903 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -152.19 75.69 7.27 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.584 0.707 . . . . 74.45 110.855 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.713 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.3 Cg_endo -69.82 -11.12 30.11 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.64 2.226 . . . . 74.1 112.308 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.07 -5.56 47.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.241 -0.436 . . . . 65.22 111.107 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.3 ttmm -83.06 -51.12 7.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 63.11 110.916 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.614 ' O ' HG12 ' A' ' 69' ' ' VAL . 88.6 m-85 -99.76 23.23 9.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.232 -0.44 . . . . 64.34 110.921 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.713 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -87.03 -20.88 26.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.484 . . . . 65.44 111.118 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.0 t -92.85 -21.06 20.09 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.2 -0.455 . . . . 72.43 110.865 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 1.052 HG21 HD11 ' A' ' 80' ' ' ILE . 7.6 p -51.55 152.27 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.495 . . . . 72.34 111.151 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -104.18 91.33 3.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 42.25 110.903 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.782 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -51.6 -35.66 42.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 73.33 111.136 -179.864 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -58.02 -43.98 87.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.221 -0.445 . . . . 72.0 110.969 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -63.83 107.98 1.35 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.094 -0.503 . . . . 61.01 110.846 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.28 -28.46 19.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 75.54 110.851 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -66.73 -55.0 17.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 63.24 110.896 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -59.58 -56.35 23.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 74.21 110.891 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.401 HG21 HG11 ' A' ' 52' ' ' VAL . 4.2 p -53.44 -32.34 20.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 74.41 111.152 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 9.8 mtm -67.41 -54.51 19.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 61.12 110.879 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.83 -37.91 69.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.263 -0.426 . . . . 71.1 110.863 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 1.052 HD11 HG21 ' A' ' 69' ' ' VAL . 84.4 mt -66.12 -53.46 36.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 71.13 111.155 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.76 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.4 mt -61.86 -36.21 72.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.459 . . . . 73.23 111.124 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 61.1 t0 -71.05 -48.26 53.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 51.3 110.864 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -60.88 -53.89 51.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 73.44 110.896 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -69.21 -11.96 61.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.475 . . . . 70.31 110.9 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt 58.45 54.53 5.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 72.43 110.872 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.76 ' HB ' HG23 ' A' ' 81' ' ' ILE . 20.5 mt -81.06 131.61 59.08 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.638 0.733 . . . . 72.45 111.094 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 159.04 54.84 Favored 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.675 2.25 . . . . 64.05 112.384 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -92.84 170.0 10.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 73.01 111.188 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.692 HG11 ' O ' ' B' ' -7' ' ' PHE . 98.4 t -52.04 -58.07 2.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.28 -0.418 . . . . 65.24 111.074 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -51.54 -51.86 51.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.451 . . . . 64.11 110.881 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 51.5 mm-40 -57.23 -38.56 73.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.136 -0.484 . . . . 64.41 110.971 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 24.2 t90 -66.39 -43.3 86.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.169 -0.469 . . . . 63.3 110.929 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -61.54 -47.92 83.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 44.41 110.927 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -64.69 -39.93 94.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.436 . . . . 73.23 110.886 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -60.39 -49.24 78.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.454 . . . . 74.43 110.94 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.444 . . . . 75.04 111.121 -179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' -7' ' ' PHE . . . . . 0.692 ' O ' HG11 ' A' ' 89' ' ' VAL . 38.8 m-85 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.893 0.378 . . . . 53.03 110.891 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 26.7 mm -110.82 81.64 2.65 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.631 0.729 . . . . 71.53 111.087 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' -5' ' ' PRO . . . . . 0.412 ' HD3' HD11 ' A' ' 49' ' ' LEU . 54.2 Cg_endo -69.74 78.46 1.0 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.667 2.245 . . . . 74.42 112.333 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 29.7 m -82.5 0.31 43.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.254 -0.43 . . . . 71.03 110.857 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 2.1 mpp_? -67.63 162.17 59.57 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.552 0.692 . . . . 64.14 110.864 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 158.88 55.48 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.651 2.234 . . . . 55.45 112.411 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -91.37 111.94 51.51 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.55 0.69 . . . . 72.12 111.101 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 149.84 67.23 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.65 2.233 . . . . 70.01 112.355 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 17.0 mtmt -99.89 161.18 25.18 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.598 0.713 . . . . 73.21 110.913 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 168.25 22.07 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.7 2.267 . . . . 55.11 112.336 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--N 1.341 0.181 0 C-N-CA 122.627 2.218 . . . . 71.14 112.368 179.962 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.43 HD12 HG23 ' A' ' 57' ' ' ILE . 1.3 pt? . . . . . 0 C--O 1.231 0.088 0 CA-C-O 120.813 0.34 . . . . 75.22 110.917 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.72 ' CD1' HD23 ' A' ' 60' ' ' LEU . 63.8 m-85 -115.26 153.68 30.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.178 -0.464 . . . . 62.4 110.892 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -129.47 152.88 48.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 72.03 111.14 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.453 HG13 ' HB3' ' A' ' 56' ' ' ARG . 6.1 p -120.49 125.65 74.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.261 -0.427 . . . . 51.1 111.127 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.725 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -66.95 131.39 45.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 75.05 111.105 -179.936 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.616 HD11 ' HB2' ' A' ' 56' ' ' ARG . 71.3 mt -102.36 -17.87 15.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 75.44 110.918 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -133.96 157.14 46.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 75.54 110.963 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -82.55 105.28 13.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 74.21 110.878 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -84.64 105.05 15.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.117 -0.492 . . . . 72.22 110.88 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.5 mttp -81.22 97.82 7.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 74.14 110.871 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.36 140.35 22.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 54.51 111.106 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -107.06 -28.86 9.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 63.34 110.89 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -129.77 -179.25 5.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.466 . . . . 70.44 110.868 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -65.02 -36.9 85.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 70.21 110.859 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -63.25 -34.91 78.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.167 -0.47 . . . . 70.14 110.88 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -77.16 140.7 40.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.179 -0.464 . . . . 72.13 110.922 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 12.3 tp -112.54 127.2 56.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.155 -0.475 . . . . 74.05 110.937 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 -72.89 125.22 27.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.247 -0.433 . . . . 74.32 110.838 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.725 ' CG1' HG21 ' A' ' 6' ' ' THR . 10.1 p -138.78 152.65 24.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 74.23 111.106 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -114.41 159.64 35.98 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.673 0.749 . . . . 74.34 110.859 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 123.18 9.83 Favored 'Trans proline' 0 C--N 1.341 0.143 0 C-N-CA 122.672 2.248 . . . . 73.13 112.346 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.09 4.53 31.12 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.696 -0.764 . . . . 60.44 112.47 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.407 ' O ' HG23 ' A' ' 5' ' ' VAL . 23.3 mm-40 -92.01 165.1 13.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.842 0.353 . . . . 72.15 110.91 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.654 ' HB3' HD12 ' A' ' 42' ' ' ILE . 7.9 m120 -110.75 128.37 55.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.151 -0.477 . . . . 72.22 110.915 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.74 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 2.1 mt -128.24 146.48 50.72 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.188 -0.46 . . . . 71.42 110.902 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.25 123.26 39.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 74.22 110.891 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 34.3 mm -70.12 144.49 13.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.468 . . . . 63.42 111.146 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 21.8 m -125.77 -37.48 2.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 74.33 110.879 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -179.11 171.54 1.34 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 41.54 111.121 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.549 ' O ' HG22 ' A' ' 88' ' ' THR . 2.7 p80 -124.25 176.85 6.16 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 71.44 110.876 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.402 ' HB3' ' HB2' ' A' ' 36' ' ' TRP . 29.5 t80 -148.03 102.78 3.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 73.31 110.942 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 60.16 18.64 8.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.139 -0.482 . . . . 74.54 110.883 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.605 ' HD2' HD12 ' A' ' 81' ' ' ILE . 44.2 m-85 61.79 20.23 11.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 75.3 110.922 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -119.47 -3.81 10.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.113 -0.494 . . . . 64.4 110.863 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.512 ' HB3' HD21 ' A' ' 49' ' ' LEU . 90.5 m95 -151.57 135.8 16.74 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.148 -0.478 . . . . 75.01 110.893 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.6 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -120.06 145.64 46.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.231 -0.44 . . . . 70.44 110.887 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.8 mm -100.83 95.12 3.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.122 -0.49 . . . . 75.14 111.119 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.74 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.18 134.91 51.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.469 . . . . 71.34 111.107 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.8 pttt -111.34 156.75 40.68 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.59 0.71 . . . . 73.2 110.885 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 115.44 4.1 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.722 2.281 . . . . 73.54 112.313 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.654 HD12 ' HB3' ' A' ' 25' ' ' ASN . 55.1 mt . . . . . 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 52.4 111.142 179.947 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--O 1.23 0.083 0 CA-C-O 120.825 0.26 . . . . 64.14 112.31 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -133.68 -156.8 8.09 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.744 -0.741 . . . . 41.23 112.496 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.512 HD21 ' HB3' ' A' ' 36' ' ' TRP . 1.7 tt -131.11 124.86 31.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.797 0.332 . . . . 61.35 110.953 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.442 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.3 p -137.23 133.46 18.37 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.613 0.72 . . . . 72.45 111.13 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.442 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.7 Cg_endo -69.75 155.63 65.46 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.644 2.23 . . . . 63.1 112.341 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.801 HG12 ' HB ' ' A' ' 71' ' ' THR . 9.4 t -68.39 -21.44 26.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.45 . . . . 74.43 111.134 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -77.24 -3.06 37.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.152 -0.476 . . . . 63.23 110.837 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -124.89 19.91 8.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.131 -0.486 . . . . 73.15 110.882 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.571 HG22 ' HA ' ' A' ' 52' ' ' VAL . 17.0 m -150.24 157.41 6.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.111 -0.495 . . . . 54.1 111.094 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.616 ' HB2' HD11 ' A' ' 7' ' ' LEU . 22.4 ttp180 -123.93 110.77 15.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 72.11 110.853 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.502 HG21 HG21 ' A' ' 80' ' ' ILE . 38.9 mm -64.69 121.37 13.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 60.41 111.135 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.423 HG23 ' HG2' ' A' ' 56' ' ' ARG . 14.8 pt -136.18 173.41 13.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.172 -0.467 . . . . 73.12 111.16 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -115.92 126.33 53.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 74.51 110.839 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.72 HD23 ' CD1' ' A' ' 3' ' ' PHE . 0.2 OUTLIER -52.49 -29.34 24.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 74.31 110.95 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.82 -26.01 19.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.216 -0.447 . . . . 73.42 110.9 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -141.61 73.76 23.91 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.611 0.72 . . . . 74.43 110.878 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.594 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 54.0 Cg_endo -69.77 -8.97 24.97 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.691 2.26 . . . . 72.22 112.387 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -102.67 -17.61 15.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 74.33 111.116 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.9 ttmm -73.44 -51.9 15.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 73.11 110.918 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.557 ' O ' HG12 ' A' ' 69' ' ' VAL . 81.5 m-85 -95.43 23.03 6.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 75.12 110.948 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.594 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -86.99 -19.96 27.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.118 -0.492 . . . . 73.22 111.075 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 8.2 p -88.67 -19.92 25.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 50.34 110.822 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 1.062 HG21 HD11 ' A' ' 80' ' ' ILE . 7.0 p -51.53 148.28 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 70.41 111.125 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -105.82 89.44 3.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 75.15 110.862 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.801 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.5 OUTLIER -51.32 -30.38 18.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 62.51 111.169 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -61.25 -48.5 81.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.187 -0.46 . . . . 65.01 110.909 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.85 112.57 2.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.159 -0.473 . . . . 75.11 110.877 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.42 -24.64 31.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.155 -0.475 . . . . 54.54 110.887 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -66.9 -54.01 26.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 74.44 110.885 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -59.83 -57.89 10.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 73.45 110.876 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.622 HG21 HG11 ' A' ' 52' ' ' VAL . 2.0 p -51.88 -32.21 14.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 74.52 111.144 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 9.9 mtm -68.11 -53.22 26.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 65.31 110.855 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.9 mttm -55.75 -38.14 69.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 60.11 110.884 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 1.062 HD11 HG21 ' A' ' 69' ' ' VAL . 30.0 mt -66.65 -55.63 17.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 63.23 111.154 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.773 HG23 ' HB ' ' A' ' 86' ' ' ILE . 93.0 mt -59.98 -36.78 69.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 51.31 111.137 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -71.22 -52.08 21.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 40.41 110.854 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -60.21 -51.16 70.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.161 -0.472 . . . . 72.52 110.876 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -70.03 -11.16 60.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 55.23 110.86 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 26.9 mmtt 58.12 49.19 11.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 74.1 110.856 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.773 ' HB ' HG23 ' A' ' 81' ' ' ILE . 14.2 mt -78.28 125.74 84.43 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.607 0.718 . . . . 70.04 111.13 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 158.3 57.43 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.682 2.255 . . . . 64.01 112.325 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.549 HG22 ' O ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -87.41 172.23 9.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 62.21 111.149 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.9 t -52.28 -51.69 30.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 74.01 111.111 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -51.6 -51.97 51.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 71.22 110.859 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 43.0 mm-40 -58.13 -40.77 82.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 72.4 110.956 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 23.6 t90 -64.89 -40.5 95.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 73.33 110.945 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.69 -52.45 60.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.233 -0.439 . . . . 71.0 110.88 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -59.18 -43.97 92.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 74.13 110.849 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -59.38 -48.81 80.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.462 . . . . 72.34 110.873 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.2 p . . . . . 0 C--N 1.329 -0.286 0 CA-C-N 116.23 -0.441 . . . . 54.3 111.142 -179.905 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' -7' ' ' PHE . . . . . 0.501 ' HB3' HD12 ' A' ' 49' ' ' LEU . 66.9 m-85 . . . . . 0 C--O 1.232 0.14 0 CA-C-O 120.781 0.324 . . . . 74.45 110.887 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.3 mm 51.81 77.08 0.48 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.57 0.7 . . . . 74.51 111.127 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 92.36 0.51 Allowed 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.654 2.236 . . . . 74.15 112.368 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 29.1 t -89.44 3.54 51.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 45.01 110.861 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.47 162.17 0.72 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.623 0.725 . . . . 74.02 110.861 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -16.16 37.65 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.653 2.236 . . . . 53.23 112.354 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.3 80.56 0.23 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.617 0.723 . . . . 70.41 111.113 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 154.1 68.1 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.691 2.261 . . . . 52.1 112.335 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -93.51 159.54 34.81 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.555 0.693 . . . . 64.21 110.87 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 166.8 26.41 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.685 2.256 . . . . 75.2 112.315 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo . . . . . 0 C--N 1.341 0.156 0 C-N-CA 122.731 2.287 . . . . 60.24 112.332 179.938 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.583 ' CD1' HD12 ' A' ' 28' ' ' ILE . 1.4 pp . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.817 0.341 . . . . 53.04 110.938 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.608 ' CE1' HD12 ' A' ' 60' ' ' LEU . 19.0 m-85 -118.49 152.05 36.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.2 -0.454 . . . . 70.11 110.869 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 1.049 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -120.06 163.14 18.1 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 73.15 111.13 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.416 ' O ' HG13 ' A' ' 5' ' ' VAL . 5.6 p -133.75 119.26 32.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 74.32 111.132 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.732 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -67.14 139.19 57.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.461 . . . . 73.12 111.127 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.0 mt -106.02 -18.37 14.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.265 -0.425 . . . . 61.01 110.941 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -139.06 163.9 31.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.168 -0.469 . . . . 71.12 110.945 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -80.44 113.45 18.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.114 -0.494 . . . . 73.11 110.908 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -98.17 111.57 23.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.217 -0.447 . . . . 74.32 110.853 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.05 121.01 26.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.491 . . . . 73.42 110.906 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.446 ' HB1' ' HB3' ' A' ' 17' ' ' GLU . . . -74.93 156.53 36.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 54.12 111.126 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -124.18 -37.69 2.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.257 -0.429 . . . . 63.14 110.891 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.7 mmt180 -128.85 178.92 6.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.179 -0.464 . . . . 71.34 110.87 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -55.84 -44.54 78.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.2 -0.455 . . . . 74.14 110.872 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -54.54 -51.91 63.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 75.51 110.883 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.446 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 0.1 OUTLIER -60.55 147.94 39.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 74.05 110.858 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.3 tp -128.82 120.81 26.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.168 -0.469 . . . . 72.1 110.951 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -66.47 137.46 56.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.461 . . . . 75.23 110.859 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.732 ' CG1' HG21 ' A' ' 6' ' ' THR . 7.2 p -153.15 146.07 14.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 72.43 111.09 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.6 m -103.42 160.47 26.04 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 121.735 0.779 . . . . 71.42 110.825 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 118.36 5.64 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.685 2.257 . . . . 73.25 112.334 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.02 5.02 31.08 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.717 -0.754 . . . . 72.33 112.499 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -92.18 156.87 17.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.893 0.378 . . . . 73.42 110.899 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.498 ' CB ' HD12 ' A' ' 42' ' ' ILE . 4.7 m120 -104.45 133.76 48.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.152 -0.476 . . . . 72.01 110.864 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.544 HD11 HG21 ' A' ' 20' ' ' VAL . 4.4 mp -133.82 149.47 51.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.475 . . . . 73.33 110.929 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.8 t -100.86 112.59 25.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 53.23 110.869 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 1.049 HD11 ' HB2' ' A' ' 4' ' ' ALA . 57.5 mt -77.02 150.83 5.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.133 -0.485 . . . . 73.11 111.15 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 34.0 m -125.85 -36.69 2.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 74.0 110.858 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.0 179.2 9.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.456 . . . . 55.33 111.069 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.712 ' O ' HG23 ' A' ' 89' ' ' VAL . 1.5 p80 -132.82 178.21 7.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 71.25 110.806 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -137.8 99.09 3.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.167 -0.47 . . . . 72.44 110.947 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.9 t70 53.07 26.54 4.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.469 . . . . 71.41 110.862 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.592 ' HD2' HD12 ' A' ' 81' ' ' ILE . 23.4 m-85 62.85 26.06 15.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 64.42 110.903 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.433 ' O ' HG23 ' A' ' 52' ' ' VAL . 12.2 mm-40 -114.48 -40.27 3.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.13 -0.487 . . . . 74.25 110.894 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -122.3 155.48 35.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.12 -0.491 . . . . 73.41 110.95 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.759 ' CD2' HG22 ' A' ' 52' ' ' VAL . 2.4 m-85 -128.19 130.83 48.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 64.45 110.855 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 48' ' ' GLY . 19.0 mm -91.33 94.12 4.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 64.34 111.128 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -116.23 157.07 25.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 70.33 111.116 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.3 pttp -123.25 156.84 62.8 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.564 0.697 . . . . 74.31 110.9 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 127.85 15.2 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.664 2.243 . . . . 74.41 112.401 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.498 HD12 ' CB ' ' A' ' 25' ' ' ASN . 60.1 mt . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 72.51 111.11 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo . . . . . 0 C--O 1.231 0.153 0 CA-C-O 120.805 0.252 . . . . 54.32 112.373 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.663 ' O ' HG23 ' A' ' 38' ' ' ILE . . . -136.83 -120.51 1.95 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.713 -0.756 . . . . 54.41 112.443 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -159.45 125.9 4.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.832 0.348 . . . . 73.34 110.891 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.694 HG21 HG21 ' A' ' 55' ' ' VAL . 3.0 m -136.47 138.88 27.94 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.606 0.717 . . . . 65.53 111.134 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 130.01 18.57 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.664 2.243 . . . . 70.12 112.369 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.759 HG22 ' CD2' ' A' ' 37' ' ' PHE . 22.1 t -57.35 -21.69 15.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 71.24 111.132 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.4 p -74.34 -6.26 47.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 53.33 110.888 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -119.52 -25.27 6.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.101 -0.5 . . . . 72.52 110.893 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.868 HG13 ' HB1' ' A' ' 4' ' ' ALA . 1.3 t -106.16 138.69 30.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 73.3 111.105 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.8 ttp180 -111.2 123.64 50.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 64.22 110.855 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.739 HD11 ' CE2' ' A' ' 37' ' ' PHE . 24.2 mm -70.79 128.88 34.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 74.45 111.141 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 16.0 pt -145.69 174.12 3.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 61.11 111.129 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -117.84 130.19 56.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.186 -0.461 . . . . 74.44 110.872 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.608 HD12 ' CE1' ' A' ' 3' ' ' PHE . 3.8 mt -58.04 -22.73 51.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 71.24 110.895 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.4 mmt -89.54 -27.93 19.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 73.53 110.899 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -152.58 75.84 6.95 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.659 0.743 . . . . 73.5 110.857 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.738 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.9 Cg_endo -69.78 -8.52 23.82 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.676 2.251 . . . . 63.12 112.313 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.34 -15.33 24.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 71.53 111.128 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -76.16 -52.04 10.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 72.25 110.878 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.611 ' O ' HG12 ' A' ' 69' ' ' VAL . 57.6 m-85 -96.21 23.46 6.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 75.3 110.894 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.738 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -87.58 -18.02 30.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 52.43 111.08 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.0 p -89.96 -23.79 21.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 71.2 110.853 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.611 HG12 ' O ' ' A' ' 66' ' ' TYR . 8.2 p -53.32 139.17 11.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.129 -0.487 . . . . 74.53 111.097 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -94.32 91.38 6.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 74.42 110.893 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.747 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -51.3 -30.23 17.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.178 -0.465 . . . . 74.32 111.127 -179.866 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -58.95 -48.1 82.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 71.14 110.927 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -64.03 111.08 2.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.138 -0.483 . . . . 62.34 110.851 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.59 -24.76 34.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 74.43 110.874 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -66.79 -55.25 15.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.461 . . . . 65.24 110.907 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.52 ' O ' HD12 ' A' ' 80' ' ' ILE . 3.3 mt-30 -58.77 -58.32 9.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.129 -0.487 . . . . 70.43 110.909 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 1.8 p -51.45 -31.46 12.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 75.4 111.091 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.7 mtm -68.49 -51.58 41.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 73.23 110.879 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 32.8 mttt -56.36 -43.77 79.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.466 . . . . 75.12 110.9 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.52 HD12 ' O ' ' A' ' 76' ' ' GLN . 1.7 mp -63.62 -56.05 19.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 65.35 111.116 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.646 HG23 ' HB ' ' A' ' 86' ' ' ILE . 85.2 mt -55.88 -37.16 46.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.465 . . . . 75.44 111.145 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -71.23 -51.99 21.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 72.54 110.829 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -58.5 -51.21 70.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 61.41 110.906 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -67.8 -14.77 63.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 64.1 110.883 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.5 mmtt 61.09 52.83 3.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.095 -0.502 . . . . 75.22 110.931 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.646 ' HB ' HG23 ' A' ' 81' ' ' ILE . 37.3 mt -81.5 131.9 56.92 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.637 0.732 . . . . 74.43 111.103 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 153.45 68.74 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.659 2.24 . . . . 73.14 112.331 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.63 165.96 13.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 73.24 111.139 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.712 HG23 ' O ' ' A' ' 31' ' ' HIS . 86.1 t -51.24 -58.09 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 65.44 111.149 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -50.81 -51.2 53.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.176 -0.465 . . . . 73.02 110.892 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 55.5 mm-40 -57.12 -41.6 79.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.479 . . . . 74.11 110.918 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 29.3 t90 -65.37 -36.96 85.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.201 -0.454 . . . . 74.53 110.936 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.3 mmpp? -65.75 -50.08 66.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 74.31 110.875 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.62 -44.86 96.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 75.11 110.844 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 40.5 mm-40 -60.22 -47.56 85.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 73.32 110.914 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 26.4 p . . . . . 0 C--N 1.33 -0.256 0 CA-C-N 116.192 -0.458 . . . . 74.31 111.122 -179.892 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 . . . . . 0 C--O 1.231 0.127 0 CA-C-O 120.839 0.352 . . . . 74.33 110.94 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 24.3 mm 51.07 74.29 0.83 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.633 0.73 . . . . 73.4 111.115 179.932 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 127.98 15.35 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.655 2.237 . . . . 65.34 112.322 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.89 12.11 9.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 62.33 110.86 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.69 162.43 0.74 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.595 0.712 . . . . 74.1 110.866 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -11.34 30.66 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.69 2.26 . . . . 71.35 112.369 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 57.79 80.93 0.26 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.59 0.709 . . . . 72.4 111.08 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 144.04 52.64 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.703 2.269 . . . . 73.02 112.326 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 38.8 mtmt -80.29 160.87 66.94 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.544 0.687 . . . . 73.41 110.906 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 165.68 30.1 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.666 2.244 . . . . 63.1 112.344 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 C--N 1.341 0.174 0 C-N-CA 122.708 2.272 . . . . 52.22 112.309 179.96 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.681 HD21 HD11 ' A' ' 86' ' ' ILE . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.1 0 CA-C-O 120.867 0.365 . . . . 65.21 110.919 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.75 ' CZ ' HD12 ' A' ' 60' ' ' LEU . 81.0 m-85 -137.92 139.89 40.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 75.13 110.879 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.445 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -130.34 157.99 41.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.135 -0.484 . . . . 62.41 111.133 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 24' ' ' GLU . 8.5 p -124.13 128.5 74.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 71.0 111.149 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.682 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.2 OUTLIER -72.48 127.43 32.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 52.32 111.133 -179.934 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.3 mt -101.21 -18.66 16.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.204 -0.453 . . . . 63.02 110.913 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -133.78 161.56 34.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 62.45 110.898 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -82.02 105.49 13.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 65.52 110.876 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -87.28 125.46 34.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 61.43 110.879 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.43 104.39 14.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 71.04 110.874 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.678 ' HB1' ' HB2' ' A' ' 17' ' ' GLU . . . -53.53 160.37 1.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 64.24 111.094 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -118.47 -32.22 4.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 74.5 110.879 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -124.09 -175.79 3.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 62.21 110.821 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -67.07 -38.93 86.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.459 . . . . 64.12 110.852 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -59.65 -53.1 61.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.231 -0.44 . . . . 75.24 110.844 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.678 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 5.2 mm-40 -54.24 164.65 0.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.218 -0.446 . . . . 74.33 110.862 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.408 HD22 ' HD3' ' A' ' 41' ' ' PRO . 4.5 tp -139.46 142.8 37.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.489 . . . . 73.44 110.868 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -86.6 143.09 27.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.466 . . . . 71.23 110.848 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.682 ' CG1' HG21 ' A' ' 6' ' ' THR . 6.7 p -153.11 144.03 14.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.226 -0.443 . . . . 74.25 111.109 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.4 m -102.32 160.33 26.67 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.637 0.732 . . . . 42.02 110.873 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 126.38 13.26 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.652 2.235 . . . . 74.51 112.332 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.0 -0.21 31.64 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.737 -0.744 . . . . 74.53 112.508 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.409 ' O ' HG23 ' A' ' 5' ' ' VAL . 2.8 mm-40 -92.11 170.37 9.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.86 0.362 . . . . 74.5 110.86 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -116.26 130.06 56.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 74.3 110.852 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.763 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 3.1 mp -125.09 144.79 50.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.17 -0.468 . . . . 62.21 110.927 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -97.31 112.66 24.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 53.14 110.842 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.611 ' HB ' HD12 ' A' ' 2' ' ' LEU . 58.8 mt -78.86 141.52 15.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 74.23 111.108 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 55.3 m -119.33 -48.81 2.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 73.24 110.861 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.422 ' HA ' HG22 ' A' ' 86' ' ' ILE . . . -146.09 172.68 13.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 74.54 111.084 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.513 ' O ' HG23 ' A' ' 89' ' ' VAL . 1.3 p80 -128.06 178.25 6.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.242 -0.435 . . . . 70.32 110.829 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -138.77 99.88 3.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 75.15 110.933 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.1 t70 54.26 26.35 6.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.135 -0.484 . . . . 60.21 110.839 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.593 ' HD2' HD12 ' A' ' 81' ' ' ILE . 38.4 m-85 63.08 25.37 14.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.204 -0.453 . . . . 73.22 110.933 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.488 ' O ' HG23 ' A' ' 52' ' ' VAL . 14.7 mm-40 -114.11 -50.01 2.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 74.44 110.858 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.531 ' HB3' HD21 ' A' ' 49' ' ' LEU . 67.9 m95 -111.42 143.97 41.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.167 -0.47 . . . . 73.11 110.9 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.679 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -119.69 133.5 55.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.442 . . . . 74.33 110.918 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.8 mm -88.79 95.23 5.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 72.31 111.145 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.763 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.6 142.7 42.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.205 -0.452 . . . . 75.33 111.105 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.52 153.63 46.65 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.558 0.694 . . . . 72.01 110.889 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.408 ' HD3' HD22 ' A' ' 18' ' ' LEU . 53.6 Cg_endo -69.79 105.89 1.57 Allowed 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.683 2.255 . . . . 64.05 112.369 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.7 mt . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.242 -0.435 . . . . 73.43 111.107 179.976 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo . . . . . 0 N--CA 1.466 -0.141 0 CA-C-O 120.83 0.263 . . . . 74.31 112.325 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -127.7 -137.1 4.39 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.754 -0.736 . . . . 53.34 112.468 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.531 HD21 ' HB3' ' A' ' 36' ' ' TRP . 1.2 tt -149.55 125.84 10.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.861 0.362 . . . . 54.43 110.908 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 12.4 p -136.58 132.7 18.77 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.622 0.725 . . . . 62.23 111.096 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.593 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.6 Cg_endo -69.78 151.53 68.97 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.707 2.272 . . . . 64.43 112.287 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.771 HG12 ' HB ' ' A' ' 71' ' ' THR . 14.2 t -62.9 -21.9 29.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.232 -0.44 . . . . 72.41 111.155 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.1 m -78.4 -2.4 38.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 61.34 110.877 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -125.07 17.58 8.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 74.22 110.907 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.593 HG22 ' O ' ' A' ' 51' ' ' PRO . 5.2 m -153.56 153.1 9.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 73.14 111.127 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.53 ' HG2' HG23 ' A' ' 58' ' ' ILE . 18.5 ttm180 -123.75 119.84 30.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.151 -0.477 . . . . 71.21 110.915 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 16.1 mm -67.19 113.81 3.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 75.55 111.168 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.53 HG23 ' HG2' ' A' ' 56' ' ' ARG . 1.2 pt -135.33 139.07 47.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 61.33 111.126 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -75.27 122.07 23.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 71.02 110.878 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.75 HD12 ' CZ ' ' A' ' 3' ' ' PHE . 0.6 OUTLIER -51.98 -31.7 30.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.213 -0.449 . . . . 73.44 110.876 -179.912 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -85.56 -28.52 24.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 74.04 110.869 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -143.96 77.53 14.61 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.638 0.732 . . . . 63.24 110.896 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.737 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.6 Cg_endo -69.78 -8.17 22.92 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.675 2.25 . . . . 75.12 112.367 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.91 -5.69 44.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 70.13 111.125 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -84.04 -51.75 6.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 72.1 110.904 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.615 ' O ' HG12 ' A' ' 69' ' ' VAL . 12.2 m-85 -99.87 23.62 9.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 74.21 110.931 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.737 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -83.37 -15.93 47.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.122 -0.49 . . . . 62.32 111.112 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 8.9 m -98.14 -18.74 18.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.44 110.894 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 1.026 HG21 HD11 ' A' ' 80' ' ' ILE . 9.3 p -51.14 150.22 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.092 -0.504 . . . . 74.1 111.129 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -104.76 88.5 2.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 74.12 110.84 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.771 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -51.89 -43.22 63.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.219 -0.446 . . . . 63.33 111.089 -179.857 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -53.67 -43.89 69.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.282 -0.417 . . . . 74.1 110.92 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -63.92 110.15 2.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 71.11 110.864 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.23 -26.33 28.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 72.01 110.857 -179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -67.11 -56.07 11.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 71.01 110.893 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -59.2 -56.65 19.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.479 . . . . 73.34 110.902 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.414 HG21 HG11 ' A' ' 52' ' ' VAL . 2.8 p -52.48 -32.38 16.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.199 -0.455 . . . . 61.44 111.168 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 14.2 mtm -67.73 -55.0 14.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 64.21 110.879 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.5 mttt -54.34 -38.51 66.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 64.21 110.928 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 1.026 HD11 HG21 ' A' ' 69' ' ' VAL . 88.6 mt -66.05 -54.64 24.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.225 -0.443 . . . . 61.33 111.149 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.75 HG23 ' HB ' ' A' ' 86' ' ' ILE . 95.1 mt -60.37 -33.88 55.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 64.41 111.163 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -71.07 -51.84 22.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.176 -0.466 . . . . 54.33 110.83 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -60.49 -43.09 97.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 72.21 110.915 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -76.13 -17.78 59.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 74.42 110.847 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 33.5 mmtm 61.36 52.53 3.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.178 -0.464 . . . . 50.31 110.891 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.75 ' HB ' HG23 ' A' ' 81' ' ' ILE . 21.2 mt -78.4 131.09 69.59 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.639 0.733 . . . . 72.34 111.116 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.407 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 53.9 Cg_endo -69.74 158.87 55.5 Favored 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.753 2.302 . . . . 74.42 112.297 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.41 163.25 16.86 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.183 -0.462 . . . . 63.41 111.147 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 31' ' ' HIS . 96.2 t -51.01 -58.02 2.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 70.31 111.169 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -50.85 -46.8 60.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 62.43 110.873 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -59.4 -42.2 91.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 55.21 110.915 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 12.2 t90 -64.96 -41.55 95.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 62.35 110.912 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.3 mmtp -62.6 -44.67 95.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.248 -0.433 . . . . 45.11 110.903 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -64.3 -46.67 82.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.258 -0.428 . . . . 73.2 110.873 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -57.73 -53.72 55.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 72.53 110.927 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 4.6 p . . . . . 0 C--N 1.33 -0.269 0 CA-C-N 116.204 -0.453 . . . . 74.13 111.081 -179.915 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' -7' ' ' PHE . . . . . 0.467 ' HD2' HD12 ' A' ' 49' ' ' LEU . 9.3 m-85 . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.867 0.365 . . . . 74.05 110.865 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 22.2 mm 51.94 77.6 0.45 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.596 0.713 . . . . 64.35 111.106 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 92.64 0.51 Allowed 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.712 2.275 . . . . 70.51 112.324 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.09 28.53 3.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.269 -0.423 . . . . 64.21 110.884 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' -3' ' ' ARG . . . . . 0.486 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 0.5 OUTLIER -89.64 159.09 44.43 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.58 0.705 . . . . 71.34 110.883 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' -2' ' ' PRO . . . . . 0.486 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 54.1 Cg_endo -69.78 112.41 3.08 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.669 2.246 . . . . 74.34 112.356 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' -1' ' ' ALA . . . . . 0.429 ' HA ' ' HD2' ' B' ' 0' ' ' PRO . . . -51.22 108.99 1.18 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.641 0.734 . . . . 64.44 111.087 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 0' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' B' ' -1' ' ' ALA . 53.9 Cg_endo -69.8 147.14 61.98 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.647 2.231 . . . . 61.42 112.373 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 60.5 mttt -97.6 160.77 27.88 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.592 0.711 . . . . 73.41 110.868 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 167.85 23.28 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.654 2.236 . . . . 71.45 112.372 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.231 0.163 0 C-N-CA 122.666 2.244 . . . . 75.03 112.372 179.992 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.675 HD12 HD12 ' A' ' 28' ' ' ILE . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.816 0.341 . . . . 75.41 110.962 . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -124.48 143.14 50.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 73.43 110.849 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.913 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -120.88 151.98 39.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 73.41 111.088 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.495 HG13 ' HB3' ' A' ' 56' ' ' ARG . 6.2 p -120.17 122.19 67.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.196 -0.457 . . . . 64.14 111.112 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.718 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -60.24 144.53 50.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 52.05 111.118 -179.942 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.656 HD11 ' HB2' ' A' ' 56' ' ' ARG . 23.3 mt -117.48 -12.17 10.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 64.42 110.873 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -134.67 164.75 26.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.238 -0.437 . . . . 65.02 110.94 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -89.97 105.27 17.7 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.133 -0.485 . . . . 75.31 110.859 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -87.3 123.47 32.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.149 -0.478 . . . . 71.4 110.861 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.84 96.88 7.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.176 -0.466 . . . . 74.41 110.905 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.13 157.69 1.75 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.245 -0.434 . . . . 62.25 111.118 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -116.26 -30.6 5.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.21 -0.45 . . . . 72.24 110.876 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.5 mmm180 -136.2 -177.11 4.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 74.32 110.869 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -60.39 -41.2 93.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.156 -0.475 . . . . 64.44 110.873 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -56.93 -39.85 75.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.145 -0.479 . . . . 73.04 110.864 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -79.87 143.03 34.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.206 -0.452 . . . . 64.31 110.913 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.8 tp -119.89 127.8 53.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.145 -0.479 . . . . 53.01 110.869 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -72.94 139.77 46.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.209 -0.451 . . . . 65.44 110.852 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.718 ' CG1' HG21 ' A' ' 6' ' ' THR . 11.2 p -147.14 151.75 13.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.465 . . . . 72.21 111.134 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.5 m -110.23 159.91 30.27 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.657 0.741 . . . . 73.14 110.853 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 120.15 6.98 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.644 2.229 . . . . 71.22 112.357 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.08 3.64 31.46 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.76 -0.733 . . . . 53.13 112.496 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -91.97 149.47 21.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.881 0.372 . . . . 64.23 110.88 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.604 ' CB ' HD12 ' A' ' 42' ' ' ILE . 6.8 m120 -93.79 139.86 30.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 75.41 110.926 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.724 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 4.4 mp -141.23 145.4 35.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 73.42 110.903 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.1 113.9 26.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.444 . . . . 62.42 110.877 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.913 HD11 ' HB2' ' A' ' 4' ' ' ALA . 43.5 mt -77.22 149.76 6.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.153 -0.476 . . . . 73.14 111.138 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 21.3 m -123.55 -35.91 2.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 71.33 110.863 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -166.52 173.62 9.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.182 -0.463 . . . . 63.22 111.085 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.479 ' ND1' HD13 ' A' ' 81' ' ' ILE . 1.6 p80 -124.11 176.28 6.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 71.23 110.848 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -137.76 99.56 3.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 75.42 110.887 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.3 t70 55.07 24.92 6.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.105 -0.498 . . . . 74.5 110.895 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.581 ' HD2' HD12 ' A' ' 81' ' ' ILE . 35.0 m-85 64.08 15.69 9.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 63.54 110.95 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.505 ' O ' HG23 ' A' ' 52' ' ' VAL . 28.1 mm-40 -103.34 -50.65 3.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.125 -0.489 . . . . 72.55 110.858 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 83.0 m95 -111.5 162.86 14.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.146 -0.479 . . . . 75.24 110.964 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.635 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.4 OUTLIER -135.93 146.24 47.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.263 -0.426 . . . . 73.51 110.896 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 11.6 mm -104.12 95.23 3.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.142 -0.481 . . . . 64.22 111.122 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.724 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -116.42 145.07 43.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.15 -0.477 . . . . 60.41 111.075 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.0 ptpp? -116.14 157.46 45.12 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.59 0.709 . . . . 74.34 110.872 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 131.5 21.46 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.713 2.276 . . . . 35.53 112.339 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.604 HD12 ' CB ' ' A' ' 25' ' ' ASN . 40.5 mt . . . . . 0 C--N 1.328 -0.352 0 CA-C-N 116.213 -0.449 . . . . 73.3 111.116 179.929 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 N--CA 1.466 -0.118 0 CA-C-O 120.821 0.259 . . . . 35.34 112.323 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -119.57 -153.52 9.3 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.766 -0.73 . . . . 40.01 112.52 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -130.32 129.33 43.06 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.856 0.36 . . . . 75.23 110.91 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.5 p -141.15 132.04 13.42 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.668 0.746 . . . . 71.15 111.098 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.74 165.51 30.69 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.662 2.241 . . . . 72.42 112.363 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.729 HG12 ' HB ' ' A' ' 71' ' ' THR . 15.3 t -74.1 -21.24 17.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.24 -0.437 . . . . 61.42 111.154 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 56.4 m -81.3 1.8 30.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.17 -0.468 . . . . 75.44 110.832 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.559 ' O ' HG22 ' A' ' 6' ' ' THR . 13.9 m-85 -129.26 22.75 5.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 75.54 110.911 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 27.5 m -151.3 146.41 16.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 75.11 111.096 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.656 ' HB2' HD11 ' A' ' 7' ' ' LEU . 33.3 ttp85 -115.64 111.66 20.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 65.54 110.912 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.4 mm -66.05 118.55 9.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.207 -0.451 . . . . 65.14 111.074 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.459 HG23 ' HG2' ' A' ' 56' ' ' ARG . 15.3 pt -136.1 165.89 28.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 62.41 111.147 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -109.21 127.31 54.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 70.32 110.867 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.9 mt -55.48 -29.59 59.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 71.32 110.889 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.58 -20.19 28.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 74.03 110.935 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -161.45 82.1 1.93 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.648 0.737 . . . . 75.44 110.819 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.737 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.7 Cg_endo -69.75 -8.52 23.81 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.717 2.278 . . . . 72.34 112.351 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.79 0.25 56.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 75.1 111.109 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -84.31 -47.15 11.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 74.42 110.889 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.55 ' O ' HG12 ' A' ' 69' ' ' VAL . 19.0 m-85 -110.98 23.71 13.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 74.42 110.914 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.737 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -78.07 -20.82 51.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 72.21 111.077 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 80.9 p -104.59 -8.42 18.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.428 . . . . 71.23 110.846 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.949 HG21 HD11 ' A' ' 80' ' ' ILE . 9.8 p -51.37 157.84 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 70.52 111.123 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -104.09 82.46 1.97 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.138 -0.483 . . . . 71.45 110.871 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.729 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -54.29 -44.64 72.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.448 . . . . 63.41 111.093 -179.877 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -55.28 -40.92 71.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.239 -0.437 . . . . 63.11 110.948 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -63.96 108.42 1.49 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.103 -0.499 . . . . 73.23 110.852 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . 0.404 ' HA ' HG12 ' A' ' 77' ' ' VAL . 0.2 OUTLIER -51.97 -29.3 19.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.455 . . . . 61.22 110.876 -179.908 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -66.98 -56.42 10.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 73.4 110.869 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -59.23 -54.9 41.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.461 . . . . 70.23 110.936 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.52 ' HA ' HD12 ' A' ' 80' ' ' ILE . 4.8 p -54.27 -32.68 24.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 74.24 111.121 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.4 mtm -67.37 -56.04 11.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.474 . . . . 73.32 110.817 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -54.62 -37.51 65.71 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.247 -0.433 . . . . 64.43 110.911 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.949 HD11 HG21 ' A' ' 69' ' ' VAL . 27.9 mt -66.22 -55.1 20.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 70.31 111.14 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.72 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.4 mt -60.51 -36.73 71.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.153 -0.476 . . . . 70.43 111.149 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -70.93 -46.73 61.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.156 -0.475 . . . . 75.33 110.857 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -64.42 -47.1 80.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 75.32 110.853 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -72.34 -12.84 61.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 73.21 110.898 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.56 53.06 6.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.137 -0.483 . . . . 72.14 110.881 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.72 ' HB ' HG23 ' A' ' 81' ' ' ILE . 59.0 mt -83.73 132.94 47.44 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.64 0.733 . . . . 75.41 111.105 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.418 ' HD2' HG23 ' A' ' 86' ' ' ILE . 53.5 Cg_endo -69.76 163.83 36.81 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.705 2.27 . . . . 71.14 112.324 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.28 169.2 9.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.173 -0.467 . . . . 72.02 111.135 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 91.7 t -51.43 -56.53 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 71.51 111.131 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -52.43 -52.13 55.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 63.12 110.857 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 57.7 mm-40 -56.86 -42.68 80.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 55.14 110.886 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.45 ' O ' HG23 ' A' ' 96' ' ' THR . 33.4 t90 -66.1 -36.93 84.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 75.21 110.898 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -68.43 -35.03 77.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 74.42 110.892 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -72.16 -49.46 35.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 63.14 110.834 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.4 ' HG2' ' HA ' ' A' ' 92' ' ' TRP . 21.0 pt20 -61.56 -39.94 92.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 71.54 110.905 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.45 HG23 ' O ' ' A' ' 92' ' ' TRP . 38.1 p . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 73.24 111.153 -179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 . . . . . 0 C--O 1.232 0.132 0 CA-C-O 120.838 0.351 . . . . 75.11 110.868 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.0 mm 51.83 81.0 0.27 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.607 0.718 . . . . 64.35 111.092 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 81.43 0.82 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.671 2.247 . . . . 73.33 112.309 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 5.4 t -97.21 37.27 1.35 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 72.1 110.861 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' -3' ' ' ARG . . . . . 0.446 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 5.6 mmm180 -98.16 160.56 27.98 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.596 0.713 . . . . 54.45 110.879 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' -2' ' ' PRO . . . . . 0.446 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.6 Cg_endo -69.79 99.53 0.76 Allowed 'Trans proline' 0 C--N 1.34 0.13 0 C-N-CA 122.657 2.238 . . . . 74.44 112.31 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -51.13 108.96 1.17 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.542 0.687 . . . . 62.44 111.094 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 154.25 67.98 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.704 2.269 . . . . 74.51 112.334 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 12.7 mtpp -99.56 160.66 26.83 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.539 0.685 . . . . 73.24 110.87 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 167.82 23.32 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.693 2.262 . . . . 62.12 112.335 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--N 1.341 0.149 0 C-N-CA 122.683 2.255 . . . . 62.32 112.359 179.933 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.777 HD12 HD13 ' A' ' 86' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.231 0.128 0 CA-C-O 120.826 0.346 . . . . 53.13 110.923 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.463 ' CE2' HD12 ' A' ' 60' ' ' LEU . 97.1 m-85 -128.55 139.55 52.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.466 . . . . 61.45 110.866 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.477 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -133.93 159.55 40.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.49 . . . . 34.32 111.111 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.6 p -124.75 127.05 72.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 70.42 111.11 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.665 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -67.04 126.95 30.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.209 -0.451 . . . . 53.3 111.106 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.553 HD11 ' HB2' ' A' ' 56' ' ' ARG . 66.1 mt -101.73 -17.68 16.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 50.32 110.906 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -132.87 160.82 35.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 72.3 110.889 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -86.42 105.08 16.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.084 -0.507 . . . . 72.33 110.852 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -84.81 126.17 33.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 65.11 110.894 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.4 mttm -101.91 100.17 10.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.119 -0.491 . . . . 70.32 110.905 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.74 149.68 5.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 70.3 111.091 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -123.05 -36.34 2.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 73.02 110.884 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.9 mmt180 -114.56 -178.19 3.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 75.14 110.861 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -68.36 -35.68 78.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 71.23 110.865 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -67.96 -41.17 82.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.242 -0.436 . . . . 61.25 110.858 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.15 166.77 3.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 63.02 110.904 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.2 tp -142.37 149.96 40.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 44.44 110.948 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -94.67 131.46 40.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 71.53 110.867 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.665 ' CG1' HG21 ' A' ' 6' ' ' THR . 14.8 p -148.59 149.49 15.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 72.44 111.101 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.9 m -110.67 160.43 28.7 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.646 0.736 . . . . 74.44 110.859 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 128.2 15.67 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.71 2.273 . . . . 72.22 112.334 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.09 -6.02 32.28 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.709 -0.758 . . . . 54.12 112.509 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -92.2 155.18 18.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.852 0.358 . . . . 51.53 110.871 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.69 ' C ' HD22 ' A' ' 26' ' ' LEU . 7.1 m120 -96.14 139.25 32.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.03 110.917 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.69 HD22 ' C ' ' A' ' 25' ' ' ASN . 3.5 mm? -131.57 142.01 49.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.18 -0.464 . . . . 72.13 110.886 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.82 116.78 33.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.209 -0.45 . . . . 44.13 110.842 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.599 ' HB ' HD13 ' A' ' 2' ' ' LEU . 26.4 mt -84.08 146.01 7.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.106 -0.497 . . . . 72.21 111.115 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 22.9 m -118.53 -27.76 5.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 65.15 110.828 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.44 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -169.67 178.48 4.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.45 . . . . 65.53 111.128 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.469 ' ND1' HD13 ' A' ' 81' ' ' ILE . 1.6 p80 -129.47 176.59 7.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.254 -0.43 . . . . 72.32 110.862 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -137.89 99.4 3.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 74.1 110.857 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 46.6 t0 54.31 25.69 6.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 72.45 110.831 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.603 ' HD2' HD12 ' A' ' 81' ' ' ILE . 25.6 m-85 63.26 23.1 13.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.194 -0.457 . . . . 62.14 110.958 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.49 ' O ' HG23 ' A' ' 52' ' ' VAL . 21.9 mm-40 -111.79 -53.3 2.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.505 . . . . 73.33 110.899 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 79.9 m95 -109.13 144.26 37.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.152 -0.477 . . . . 74.55 110.929 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.79 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.4 OUTLIER -117.59 130.09 56.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.435 . . . . 75.15 110.873 -179.965 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.1 mm -87.9 95.11 4.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.119 -0.491 . . . . 65.11 111.153 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.683 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.09 157.75 19.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 60.13 111.066 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -132.33 157.94 76.93 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.558 0.694 . . . . 72.23 110.872 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 115.15 3.95 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.679 2.253 . . . . 75.23 112.324 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.8 mt . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.469 . . . . 75.41 111.145 179.887 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 N--CA 1.466 -0.124 0 CA-C-O 120.801 0.25 . . . . 71.25 112.353 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -128.17 -144.97 5.96 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.746 -0.74 . . . . 13.13 112.514 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -147.98 129.87 15.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.869 0.366 . . . . 71.21 110.867 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.0 p -142.36 132.83 12.59 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.634 0.731 . . . . 72.14 111.101 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.572 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.6 Cg_endo -69.78 152.27 69.18 Favored 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.656 2.238 . . . . 74.15 112.355 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.79 HG22 ' CD2' ' A' ' 37' ' ' PHE . 13.7 t -62.52 -22.31 29.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.225 -0.443 . . . . 72.22 111.146 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.9 t -78.04 -3.18 40.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.144 -0.48 . . . . 72.35 110.889 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -123.57 18.05 9.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 64.35 110.938 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.572 HG22 ' O ' ' A' ' 51' ' ' PRO . 3.8 m -153.95 149.41 12.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.093 -0.503 . . . . 72.33 111.142 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.553 ' HB2' HD11 ' A' ' 7' ' ' LEU . 21.4 ttm180 -116.41 118.12 31.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.47 . . . . 72.22 110.897 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.598 HG23 HD21 ' A' ' 2' ' ' LEU . 24.3 mm -70.12 116.47 11.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 44.32 111.132 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.534 HG23 ' HG2' ' A' ' 56' ' ' ARG . 11.3 pt -134.71 172.02 16.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.479 . . . . 61.41 111.122 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -115.06 147.17 40.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.171 -0.468 . . . . 55.24 110.85 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.463 HD12 ' CE2' ' A' ' 3' ' ' PHE . 13.2 mt -72.59 -35.54 67.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.455 . . . . 71.55 110.932 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 21.1 mmt -81.93 -25.21 35.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.142 -0.481 . . . . 70.43 110.865 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -151.94 74.13 7.77 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.605 0.717 . . . . 73.1 110.88 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.63 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.8 Cg_endo -69.71 -8.62 24.07 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.662 2.241 . . . . 75.24 112.381 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.73 -14.77 25.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.195 -0.457 . . . . 42.21 111.071 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -75.01 -51.96 12.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.273 -0.421 . . . . 75.34 110.913 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.617 ' O ' HG12 ' A' ' 69' ' ' VAL . 83.8 m-85 -95.4 23.02 6.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 74.23 110.908 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.63 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -87.57 -21.17 25.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.118 -0.492 . . . . 72.14 111.113 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.6 t -95.37 -21.12 18.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.439 . . . . 72.54 110.865 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.874 HG21 HD11 ' A' ' 80' ' ' ILE . 10.7 p -51.57 149.22 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.116 -0.493 . . . . 72.34 111.133 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -99.32 105.77 17.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 73.13 110.835 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.741 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -68.37 -39.72 81.68 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.146 -0.479 . . . . 71.23 111.115 -179.874 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 35.2 t80 -54.05 -44.31 70.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 74.35 110.922 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.99 108.94 1.63 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 72.34 110.854 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.6 -25.18 37.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 74.12 110.839 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -66.48 -54.75 20.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.185 -0.462 . . . . 74.32 110.948 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 3.8 mm100 -59.27 -57.09 14.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.079 -0.509 . . . . 64.35 110.943 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -52.66 -31.56 16.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 70.04 111.132 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.9 mtm -68.25 -54.31 18.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.135 -0.484 . . . . 62.25 110.849 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.0 mttm -55.69 -39.95 71.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.43 . . . . 75.21 110.857 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.874 HD11 HG21 ' A' ' 69' ' ' VAL . 67.4 mt -64.93 -54.36 30.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 53.2 111.108 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.669 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.9 mt -59.98 -29.65 43.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 74.22 111.128 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -70.76 -52.7 19.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 75.43 110.855 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.01 -31.37 71.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 72.42 110.898 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -81.32 -6.48 58.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.156 -0.475 . . . . 71.35 110.852 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 50.7 42.81 27.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.163 -0.471 . . . . 41.35 110.923 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.777 HD13 HD12 ' A' ' 2' ' ' LEU . 3.8 mt -81.01 119.06 74.95 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.665 0.745 . . . . 75.32 111.091 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.44 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 53.8 Cg_endo -69.77 155.8 64.97 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.699 2.266 . . . . 64.15 112.336 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.19 176.97 9.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.444 . . . . 55.43 111.129 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.8 t -57.67 -53.02 50.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.221 -0.445 . . . . 72.23 111.099 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -51.63 -49.19 62.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 61.33 110.887 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 67.6 mm-40 -58.82 -41.13 86.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 71.35 110.892 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 30.0 t90 -64.68 -42.61 95.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.195 -0.457 . . . . 71.43 110.911 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -61.98 -50.42 72.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.451 . . . . 75.21 110.915 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -61.43 -41.35 97.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 75.21 110.86 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -59.88 -51.07 71.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 74.41 110.855 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.1 p . . . . . 0 C--N 1.33 -0.264 0 CA-C-N 116.24 -0.436 . . . . 70.44 111.13 -179.883 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.804 0.335 . . . . 64.11 110.832 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 23.8 mm 51.31 77.97 0.43 Allowed Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.632 0.729 . . . . 53.22 111.131 -179.998 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 90.96 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.66 2.24 . . . . 53.42 112.32 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 16.3 t -102.79 34.56 2.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 72.02 110.853 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' -3' ' ' ARG . . . . . 0.427 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 3.3 mtp85 -95.31 160.3 30.97 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.554 0.693 . . . . 74.45 110.93 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' -2' ' ' PRO . . . . . 0.427 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.9 Cg_endo -69.78 102.51 1.04 Allowed 'Trans proline' 0 N--CA 1.466 -0.145 0 C-N-CA 122.718 2.279 . . . . 55.24 112.381 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -51.05 108.9 1.15 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.615 0.721 . . . . 64.3 111.139 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.71 150.94 69.18 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.745 2.297 . . . . 71.43 112.301 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -97.95 160.87 27.38 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.53 0.681 . . . . 73.12 110.92 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.76 167.88 23.16 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.649 2.232 . . . . 74.03 112.368 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--N 1.342 0.186 0 C-N-CA 122.61 2.207 . . . . 73.52 112.373 179.938 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.768 HD11 HG13 ' A' ' 28' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.838 0.351 . . . . 65.32 110.889 . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.638 ' CD1' HD13 ' A' ' 60' ' ' LEU . 95.0 m-85 -134.65 140.01 45.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 74.32 110.902 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -111.24 169.76 8.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.485 . . . . 71.41 111.063 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.415 HG12 HG12 ' A' ' 58' ' ' ILE . 7.6 p -136.94 124.93 33.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.459 . . . . 61.52 111.1 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.773 HG21 HG11 ' A' ' 20' ' ' VAL . 0.2 OUTLIER -73.07 147.48 44.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 74.44 111.161 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.511 HD11 ' HB2' ' A' ' 56' ' ' ARG . 18.0 mt -118.14 -11.82 10.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.234 -0.439 . . . . 73.14 110.909 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -140.18 166.91 23.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 74.34 110.967 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -89.88 110.04 21.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 64.23 110.896 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.469 ' HB3' HG12 ' A' ' 20' ' ' VAL . 23.0 t80 -91.43 116.15 28.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 75.54 110.887 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.56 108.44 19.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.497 . . . . 72.14 110.878 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.27 158.98 15.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 75.25 111.09 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -124.68 -37.14 2.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.256 -0.429 . . . . 60.1 110.872 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.8 mmt180 -122.29 167.16 13.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.475 . . . . 75.5 110.875 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -53.63 -40.76 66.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 65.32 110.887 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -65.04 -25.35 67.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.254 -0.43 . . . . 75.32 110.858 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -90.29 129.07 36.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 72.41 110.909 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 4.8 tp -108.29 145.07 34.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 61.03 110.879 -179.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -89.09 150.26 22.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 75.32 110.876 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.773 HG11 HG21 ' A' ' 6' ' ' THR . 8.8 p -147.43 156.16 10.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 74.23 111.136 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 14.1 p -111.02 154.51 43.41 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.638 0.732 . . . . 54.34 110.879 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 128.17 15.66 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.691 2.261 . . . . 74.25 112.402 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.8 -2.93 60.48 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.794 -0.717 . . . . 63.03 112.521 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -85.6 158.41 20.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.846 0.355 . . . . 74.13 110.901 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.488 ' C ' HD22 ' A' ' 26' ' ' LEU . 3.4 m120 -101.39 131.95 47.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 71.41 110.903 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.819 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 3.1 mm? -123.66 159.97 28.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.161 -0.472 . . . . 74.14 110.918 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.81 112.88 25.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.446 . . . . 72.31 110.89 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.768 HG13 HD11 ' A' ' 2' ' ' LEU . 38.2 mm -70.88 143.27 14.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.126 -0.488 . . . . 71.35 111.169 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.2 m -122.92 -35.83 2.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 50.12 110.861 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.477 ' HB1' ' C ' ' A' ' 88' ' ' THR . . . -170.78 173.4 5.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 74.14 111.118 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.566 ' O ' HG23 ' A' ' 89' ' ' VAL . 1.8 p80 -128.12 176.18 7.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 73.11 110.859 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -137.78 99.86 4.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 73.21 110.902 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.5 t0 54.4 25.75 6.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.119 -0.491 . . . . 73.44 110.798 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.595 ' HD2' HD12 ' A' ' 81' ' ' ILE . 37.6 m-85 63.27 26.34 15.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.224 -0.443 . . . . 74.43 110.911 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.466 ' O ' HG23 ' A' ' 52' ' ' VAL . 16.9 mm-40 -115.64 -46.56 2.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.103 -0.499 . . . . 72.42 110.882 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.413 ' HB3' HD21 ' A' ' 49' ' ' LEU . 82.5 m95 -114.73 146.95 40.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.177 -0.465 . . . . 75.41 110.894 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.62 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -123.82 143.66 50.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 71.11 110.902 -179.999 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.45 HG21 ' CZ3' ' A' ' 92' ' ' TRP . 19.6 mm -101.22 98.49 6.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 43.44 111.131 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.819 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.86 138.36 47.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.155 -0.475 . . . . 62.42 111.131 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -112.59 157.56 39.94 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.571 0.7 . . . . 70.12 110.906 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 131.24 20.87 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.659 2.239 . . . . 62.02 112.388 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.468 HD12 ' CB ' ' A' ' 25' ' ' ASN . 35.9 mt . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.227 -0.442 . . . . 74.12 111.134 179.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--O 1.23 0.122 0 CA-C-O 120.843 0.268 . . . . 63.04 112.312 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -117.68 -166.87 14.07 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.776 -0.726 . . . . 43.33 112.541 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.505 HD12 ' CD2' ' B' ' -7' ' ' PHE . 0.4 OUTLIER -120.9 124.83 45.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.897 0.38 . . . . 63.22 110.857 -179.898 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.435 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.2 p -134.94 133.13 20.75 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.635 0.731 . . . . 71.21 111.132 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.494 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.6 Cg_endo -69.75 153.87 68.44 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.721 2.281 . . . . 75.54 112.332 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.744 HG12 ' HB ' ' A' ' 71' ' ' THR . 11.8 t -65.55 -21.65 29.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.204 -0.453 . . . . 72.23 111.151 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 7.1 m -78.57 -1.86 36.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 62.14 110.8 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -121.38 2.18 10.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.185 -0.461 . . . . 62.23 110.921 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.494 HG22 ' O ' ' A' ' 51' ' ' PRO . 17.0 m -139.45 160.16 28.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.493 . . . . 62.31 111.111 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.511 ' HB2' HD11 ' A' ' 7' ' ' LEU . 17.9 ttm180 -127.26 123.64 36.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.167 -0.47 . . . . 71.54 110.862 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.482 HD11 ' CE2' ' A' ' 37' ' ' PHE . 24.8 mm -74.39 110.29 8.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.471 . . . . 35.11 111.129 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.449 HG23 ' HG2' ' A' ' 56' ' ' ARG . 6.7 pt -124.27 -177.87 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.155 -0.475 . . . . 75.32 111.138 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -128.64 145.9 51.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 71.55 110.908 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.638 HD13 ' CD1' ' A' ' 3' ' ' PHE . 1.5 mp -73.29 -38.3 65.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 71.21 110.926 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.83 -24.12 52.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 72.44 110.912 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -155.31 75.96 5.16 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.626 0.727 . . . . 73.44 110.856 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.718 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 54.3 Cg_endo -69.72 -8.32 23.31 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.663 2.242 . . . . 64.33 112.367 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.81 -15.36 23.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.447 . . . . 44.31 111.085 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -77.73 -51.66 10.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.252 -0.431 . . . . 64.33 110.914 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.429 ' HA ' HG23 ' A' ' 69' ' ' VAL . 57.1 m-85 -95.35 23.15 6.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.255 -0.429 . . . . 74.45 110.915 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.718 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -88.03 -23.81 23.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.095 -0.502 . . . . 70.21 111.1 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 13.0 p -91.68 -9.72 42.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 65.31 110.835 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.429 HG23 ' HA ' ' A' ' 66' ' ' TYR . 55.2 t -51.49 139.94 6.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.14 -0.482 . . . . 65.5 111.101 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -94.77 75.42 3.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.476 . . . . 73.41 110.867 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.744 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -46.92 -34.58 5.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 65.43 111.127 -179.886 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -57.94 -45.19 86.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 71.32 110.903 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -69.67 114.82 8.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 74.53 110.903 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.08 -23.98 37.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.214 -0.448 . . . . 71.01 110.858 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -66.81 -57.68 6.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 74.21 110.843 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.692 ' O ' HD12 ' A' ' 80' ' ' ILE . 4.2 mm-40 -57.64 -57.59 12.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 70.03 110.944 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.7 p -51.43 -32.12 12.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 72.22 111.162 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.7 mtm -68.17 -51.64 43.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.476 . . . . 73.4 110.852 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.9 mttm -55.83 -42.67 76.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 74.02 110.904 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.692 HD12 ' O ' ' A' ' 76' ' ' GLN . 1.6 mp -64.79 -55.04 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 53.03 111.149 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.595 HD12 ' HD2' ' A' ' 34' ' ' TYR . 90.5 mt -57.7 -37.53 59.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 74.34 111.087 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -71.08 -52.02 21.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 73.42 110.896 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -58.94 -51.35 70.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 65.34 110.844 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -68.66 -14.1 62.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.145 -0.479 . . . . 71.53 110.883 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? 58.76 54.23 5.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 74.51 110.914 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.537 ' HB ' HG23 ' A' ' 81' ' ' ILE . 22.6 mt -81.74 131.19 58.3 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.655 0.74 . . . . 75.24 111.134 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 158.23 57.66 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.685 2.257 . . . . 71.22 112.363 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.477 ' C ' ' HB1' ' A' ' 30' ' ' ALA . 0.1 OUTLIER -85.37 169.94 13.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 74.2 111.164 -179.957 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.829 HG12 ' HE2' ' A' ' 93' ' ' LYS . 25.4 t -51.51 -52.04 22.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 71.33 111.116 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -59.87 -47.48 85.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 42.13 110.891 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -57.48 -27.84 62.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.127 -0.488 . . . . 45.01 110.94 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.45 ' CZ3' HG21 ' A' ' 38' ' ' ILE . 26.8 t90 -73.27 -48.01 38.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 72.53 110.94 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.829 ' HE2' HG12 ' A' ' 89' ' ' VAL . 11.6 mtmt -64.86 -39.97 94.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.219 -0.446 . . . . 75.13 110.905 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -70.23 -43.51 70.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.464 . . . . 72.32 110.867 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 39.7 mm-40 -61.37 -45.96 92.19 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.18 -0.464 . . . . 72.11 110.917 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.3 p . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 73.31 111.141 -179.94 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' -7' ' ' PHE . . . . . 0.505 ' CD2' HD12 ' A' ' 49' ' ' LEU . 28.8 m-85 . . . . . 0 C--O 1.232 0.158 0 CA-C-O 120.803 0.335 . . . . 73.25 110.837 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 27.9 mm 51.39 76.21 0.57 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.573 0.701 . . . . 43.3 111.153 179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 104.58 1.34 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.693 2.262 . . . . 75.12 112.354 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 31.0 t -96.47 5.08 51.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 54.41 110.829 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -51.68 162.15 0.78 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.637 0.732 . . . . 74.32 110.891 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -19.09 36.76 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.669 2.246 . . . . 74.11 112.357 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 63.69 82.6 0.21 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.628 0.728 . . . . 62.44 111.117 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 140.75 43.47 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.681 2.254 . . . . 53.11 112.349 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 26.3 mtmm -72.14 160.72 81.95 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.582 0.706 . . . . 55.35 110.889 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 167.75 23.54 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.704 2.269 . . . . 64.02 112.329 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 C--N 1.342 0.208 0 C-N-CA 122.638 2.226 . . . . 65.45 112.367 179.919 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.5 pp . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.858 0.361 . . . . 73.23 110.885 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -128.97 148.17 50.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 71.3 110.902 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.439 ' HB2' ' CD1' ' A' ' 28' ' ' ILE . . . -122.7 168.6 12.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.137 -0.483 . . . . 73.25 111.09 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.4 p -134.27 130.17 54.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 64.11 111.127 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.738 HG21 HG11 ' A' ' 20' ' ' VAL . 0.9 OUTLIER -72.74 142.47 48.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 73.43 111.143 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.74 HD11 ' HB2' ' A' ' 56' ' ' ARG . 5.7 mt -117.6 -17.1 10.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.452 . . . . 70.43 110.91 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -129.29 167.95 16.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.178 -0.465 . . . . 74.14 110.949 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -92.14 112.19 24.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.119 -0.491 . . . . 74.24 110.868 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -92.17 123.16 35.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.129 -0.487 . . . . 72.01 110.92 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.9 mttt -101.96 101.01 11.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 75.23 110.958 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.451 ' HB1' ' HB3' ' A' ' 17' ' ' GLU . . . -61.17 155.65 20.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.439 . . . . 72.3 111.109 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -122.72 -35.99 2.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 75.22 110.841 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -121.67 -176.49 3.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.156 -0.475 . . . . 71.1 110.844 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -68.23 -38.45 81.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 65.11 110.855 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -63.7 -32.95 74.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 71.14 110.846 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.451 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 0.6 OUTLIER -79.3 147.71 32.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.436 . . . . 75.34 110.846 -179.888 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.413 HD22 ' HA3' ' A' ' 48' ' ' GLY . 8.7 tp -127.5 121.6 31.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.113 -0.494 . . . . 74.14 110.909 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -77.32 144.07 38.32 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.236 -0.438 . . . . 72.22 110.882 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.738 HG11 HG21 ' A' ' 6' ' ' THR . 7.0 p -149.89 154.71 8.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 62.14 111.176 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.0 m -105.84 156.14 37.11 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.715 0.769 . . . . 74.44 110.864 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.86 139.88 40.96 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.703 2.269 . . . . 74.0 112.341 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.35 -4.99 74.32 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.741 -0.742 . . . . 64.04 112.461 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -89.54 146.08 24.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.868 0.366 . . . . 74.34 110.918 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -89.76 123.7 33.99 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 65.41 110.884 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.782 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 3.3 mm? -116.08 145.64 42.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 72.43 110.877 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.2 t -101.24 112.89 25.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.154 -0.475 . . . . 45.35 110.862 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.439 ' CD1' ' HB2' ' A' ' 4' ' ' ALA . 56.6 mt -78.36 144.57 11.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.099 -0.5 . . . . 74.42 111.141 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.2 m -117.95 -41.94 2.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.18 -0.464 . . . . 73.4 110.837 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.37 175.35 14.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 54.21 111.081 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.411 ' O ' HG22 ' A' ' 88' ' ' THR . 2.4 p80 -127.22 178.52 5.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 75.44 110.838 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -150.88 107.22 3.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.212 -0.449 . . . . 74.43 110.951 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 57.62 20.07 5.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.143 -0.481 . . . . 73.41 110.906 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.636 ' HD2' HD12 ' A' ' 81' ' ' ILE . 32.7 m-85 58.84 21.88 9.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 72.33 110.912 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -118.17 -24.81 6.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 71.12 110.866 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -130.23 135.87 48.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 73.23 110.903 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.614 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -118.56 138.79 52.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.254 -0.43 . . . . 74.44 110.859 -179.942 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.2 mm -93.77 94.17 4.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 71.45 111.119 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.782 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -109.97 149.64 29.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 73.32 111.11 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.2 pttp -124.9 158.01 64.42 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.576 0.703 . . . . 74.44 110.913 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 153.94 68.29 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.671 2.248 . . . . 73.11 112.343 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.416 HG22 ' O ' ' A' ' 42' ' ' ILE . 29.0 mt . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 72.01 111.118 179.931 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 N--CA 1.465 -0.16 0 CA-C-O 120.794 0.248 . . . . 52.31 112.351 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.413 ' HA3' HD22 ' A' ' 18' ' ' LEU . . . -121.79 163.69 15.15 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.697 -0.763 . . . . 34.43 112.476 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.558 HD12 ' HB3' ' B' ' -7' ' ' PHE . 1.0 OUTLIER -108.89 124.68 51.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.853 0.359 . . . . 73.3 110.933 -179.938 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.444 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.2 p -143.3 133.21 11.94 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.665 0.745 . . . . 53.23 111.119 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.444 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.2 Cg_endo -69.76 152.42 69.29 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.707 2.271 . . . . 52.44 112.284 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.73 HG12 ' HB ' ' A' ' 71' ' ' THR . 12.4 t -64.92 -20.75 28.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 60.13 111.132 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.6 m -79.56 0.41 29.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 74.41 110.837 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.402 ' CD1' ' HG2' ' A' ' 51' ' ' PRO . 27.5 m-85 -127.63 18.61 6.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 72.2 110.926 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.5 m -151.9 160.29 3.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.097 -0.501 . . . . 74.43 111.109 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.74 ' HB2' HD11 ' A' ' 7' ' ' LEU . 20.1 ttp180 -123.62 129.43 51.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 74.15 110.885 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 44.6 mm -81.89 111.95 19.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 72.43 111.169 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.589 HG23 ' HG2' ' A' ' 56' ' ' ARG . 13.6 pt -129.98 -178.28 2.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 54.45 111.125 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -129.15 129.63 45.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.189 -0.46 . . . . 75.31 110.85 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.4 mt -55.19 -26.2 37.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 64.51 110.89 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.51 -30.77 16.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 72.11 110.873 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -141.05 73.92 26.03 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.578 0.704 . . . . 75.45 110.862 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.641 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.8 Cg_endo -69.8 -13.77 35.02 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.66 2.24 . . . . 64.35 112.312 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.99 -16.14 20.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.237 -0.438 . . . . 61.33 111.122 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.9 ttmt -74.26 -52.17 13.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 73.25 110.89 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.618 ' O ' HG12 ' A' ' 69' ' ' VAL . 68.0 m-85 -95.41 23.17 6.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.195 -0.457 . . . . 64.42 110.931 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.641 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -87.0 -18.76 29.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 52.24 111.068 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.3 p -95.93 -21.22 18.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.24 -0.436 . . . . 64.04 110.825 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.937 HG21 HD11 ' A' ' 80' ' ' ILE . 9.6 p -51.45 145.54 2.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.138 -0.483 . . . . 71.41 111.107 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.44 106.43 18.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.173 -0.467 . . . . 71.05 110.852 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.73 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -70.59 -35.79 73.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 74.45 111.097 -179.861 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -60.66 -41.52 95.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.186 -0.461 . . . . 70.42 110.928 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 57.4 t0 -63.94 107.85 1.34 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.138 -0.483 . . . . 72.43 110.854 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.15 -27.08 31.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 61.24 110.868 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -67.15 -55.26 14.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 65.33 110.912 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -59.71 -56.58 20.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 71.22 110.879 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.48 ' HA ' HD12 ' A' ' 80' ' ' ILE . 2.4 p -52.81 -31.7 16.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 51.21 111.131 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 11.4 mtm -68.02 -56.08 10.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 61.05 110.932 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 41.1 mttm -54.84 -36.96 65.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 75.44 110.919 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.937 HD11 HG21 ' A' ' 69' ' ' VAL . 27.0 mt -66.91 -55.18 18.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 71.12 111.116 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.701 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.9 mt -60.57 -36.05 67.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.461 . . . . 72.12 111.092 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -71.27 -50.17 35.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 74.53 110.864 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -62.82 -47.04 85.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 62.21 110.884 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -70.72 -14.08 62.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 63.22 110.908 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.85 54.94 4.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.483 . . . . 74.44 110.856 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.701 ' HB ' HG23 ' A' ' 81' ' ' ILE . 49.9 mt -85.12 132.18 46.27 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.602 0.715 . . . . 62.23 111.125 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 161.07 47.36 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.671 2.247 . . . . 65.12 112.361 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.411 HG22 ' O ' ' A' ' 31' ' ' HIS . 0.2 OUTLIER -97.31 165.67 11.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.248 -0.433 . . . . 73.42 111.203 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 87.2 t -50.84 -52.66 16.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.262 -0.427 . . . . 60.32 111.112 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -52.22 -52.17 53.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 72.02 110.931 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -58.04 -42.75 86.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.148 -0.478 . . . . 74.43 110.912 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.434 ' O ' HG23 ' A' ' 96' ' ' THR . 55.5 t90 -65.32 -36.26 83.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.219 -0.446 . . . . 73.12 110.94 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? -68.29 -37.82 81.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 64.54 110.907 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -69.81 -50.52 42.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 62.53 110.885 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.4 ' HG2' ' HA ' ' A' ' 92' ' ' TRP . 4.3 pt20 -59.89 -39.66 86.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 74.35 110.901 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.434 HG23 ' O ' ' A' ' 92' ' ' TRP . 30.8 p . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 73.32 111.163 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' -7' ' ' PHE . . . . . 0.558 ' HB3' HD12 ' A' ' 49' ' ' LEU . 31.3 m-85 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.796 0.331 . . . . 72.43 110.896 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 22.1 mm 50.25 78.22 0.41 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.611 0.719 . . . . 55.11 111.14 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 97.09 0.62 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.661 2.241 . . . . 64.44 112.337 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 28.7 t -95.99 3.28 53.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.197 -0.456 . . . . 70.14 110.863 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.54 162.39 0.71 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.637 0.732 . . . . 74.25 110.874 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 -17.94 37.17 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.674 2.249 . . . . 71.52 112.322 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 63.89 84.04 0.19 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.618 0.723 . . . . 60.03 111.097 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 140.01 41.79 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.696 2.264 . . . . 64.02 112.36 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -73.6 160.59 81.87 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.602 0.715 . . . . 73.04 110.909 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 167.1 25.47 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.667 2.245 . . . . 74.22 112.323 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo . . . . . 0 N--CA 1.465 -0.17 0 C-N-CA 122.703 2.269 . . . . 74.11 112.401 179.915 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.568 ' CD1' HD12 ' A' ' 28' ' ' ILE . 1.1 pp . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.826 0.346 . . . . 75.32 110.924 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -126.03 156.65 39.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 61.14 110.848 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.924 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -133.43 156.05 48.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 63.0 111.088 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.473 HG13 ' HB3' ' A' ' 56' ' ' ARG . 6.1 p -123.36 121.63 63.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 73.44 111.187 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.703 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -64.95 140.73 58.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 75.33 111.169 -179.952 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.76 HD11 ' HB2' ' A' ' 56' ' ' ARG . 8.2 mt -116.71 -13.87 10.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.262 -0.426 . . . . 73.32 110.923 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -134.98 158.58 43.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.172 -0.467 . . . . 72.1 110.939 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.56 105.22 14.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.117 -0.492 . . . . 64.03 110.897 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -86.64 132.86 33.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.159 -0.473 . . . . 74.43 110.904 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.01 98.61 7.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 62.13 110.873 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.13 159.45 1.25 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.426 . . . . 60.15 111.096 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -116.4 -23.93 8.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 52.11 110.895 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.5 mmm-85 -141.14 -177.51 5.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 74.32 110.86 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -58.18 -46.08 86.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 65.14 110.875 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -52.32 -52.65 51.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 74.25 110.844 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.9 mp0 -67.01 151.16 48.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 50.43 110.872 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.0 tp -125.87 151.71 46.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.155 -0.475 . . . . 75.23 110.886 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -95.13 142.25 27.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 54.32 110.867 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.736 HG21 HD11 ' A' ' 26' ' ' LEU . 14.6 p -152.45 150.14 13.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.18 -0.464 . . . . 74.13 111.128 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.3 m -105.96 159.64 28.94 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.682 0.753 . . . . 73.23 110.84 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.68 121.82 8.52 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.732 2.288 . . . . 62.4 112.363 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.13 1.77 31.58 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.68 -0.771 . . . . 71.11 112.483 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -92.14 156.96 16.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.855 0.359 . . . . 60.52 110.869 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -100.88 131.69 46.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.48 . . . . 72.41 110.921 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.736 HD11 HG21 ' A' ' 20' ' ' VAL . 4.7 mp -130.83 146.27 52.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.207 -0.451 . . . . 70.14 110.896 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.14 115.97 31.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 72.12 110.876 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.924 HD11 ' HB2' ' A' ' 4' ' ' ALA . 43.9 mt -80.8 150.46 4.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 74.12 111.12 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 24.7 m -123.93 -41.7 2.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 55.43 110.868 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -154.63 -178.42 7.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 54.32 111.124 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.619 ' O ' HG23 ' A' ' 89' ' ' VAL . 1.8 p80 -134.62 175.25 9.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 73.45 110.858 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.466 ' OH ' HG23 ' B' ' -6' ' ' ILE . 33.4 t80 -137.39 100.29 4.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.233 -0.44 . . . . 73.54 110.929 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 55.58 25.63 8.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.098 -0.501 . . . . 74.0 110.886 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.57 ' HD2' HD12 ' A' ' 81' ' ' ILE . 35.0 m-85 63.61 16.4 9.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 73.13 110.935 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.627 ' O ' HG23 ' A' ' 52' ' ' VAL . 10.0 mm-40 -104.03 -54.89 2.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.123 -0.489 . . . . 54.25 110.886 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 39.1 m95 -105.65 151.7 24.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.156 -0.475 . . . . 75.14 110.935 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.8 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -124.75 135.89 53.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 62.24 110.874 -179.958 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.7 mm -93.13 95.98 5.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 71.44 111.136 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.547 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -113.79 153.96 28.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 71.1 111.109 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 ptmt -126.73 157.6 70.76 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.568 0.699 . . . . 64.12 110.882 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 130.92 20.22 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.666 2.244 . . . . 75.33 112.346 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 76.9 mt . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.427 . . . . 62.34 111.11 179.925 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo . . . . . 0 C--O 1.23 0.117 0 CA-C-O 120.859 0.275 . . . . 73.23 112.304 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -116.11 -122.46 3.44 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.728 -0.749 . . . . 23.13 112.471 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -153.69 124.79 7.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.837 0.351 . . . . 41.44 110.932 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.0 p -134.87 132.76 20.6 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.646 0.736 . . . . 72.2 111.152 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.474 ' O ' HG22 ' A' ' 55' ' ' VAL . 54.0 Cg_endo -69.7 150.49 68.67 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.711 2.274 . . . . 74.42 112.381 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.8 HG22 ' CD2' ' A' ' 37' ' ' PHE . 52.9 t -58.17 -22.6 19.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 75.51 111.134 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -77.93 -3.89 44.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 74.0 110.829 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.639 ' O ' HG22 ' A' ' 6' ' ' THR . 14.9 m-85 -122.25 18.6 10.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.465 . . . . 73.23 110.935 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.474 HG22 ' O ' ' A' ' 51' ' ' PRO . 3.8 m -153.92 140.07 11.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 71.32 111.097 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.76 ' HB2' HD11 ' A' ' 7' ' ' LEU . 20.2 ttm180 -112.87 117.01 30.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 71.51 110.861 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 31.3 mm -66.84 109.18 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.206 -0.452 . . . . 74.5 111.129 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.566 HG23 ' HG2' ' A' ' 56' ' ' ARG . 3.5 pt -130.91 170.09 20.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 74.41 111.18 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -114.41 141.24 47.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.197 -0.456 . . . . 62.04 110.846 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.29 -24.99 66.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 63.22 110.92 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.85 -28.98 17.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 74.13 110.87 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -148.73 73.6 10.47 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.59 0.709 . . . . 53.14 110.839 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.586 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.2 Cg_endo -69.79 -10.87 29.59 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.709 2.273 . . . . 70.41 112.331 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.69 -12.67 33.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 72.41 111.095 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.6 ttmm -74.44 -52.06 13.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.459 . . . . 74.15 110.905 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.533 ' HA ' HG23 ' A' ' 69' ' ' VAL . 73.4 m-85 -98.38 23.11 8.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 71.14 110.926 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.586 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -81.43 -21.97 38.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.108 -0.497 . . . . 65.41 111.08 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.2 t -96.96 -12.68 23.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 65.2 110.829 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.533 HG23 ' HA ' ' A' ' 66' ' ' TYR . 55.4 t -51.44 141.73 4.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 63.02 111.157 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -91.35 76.13 5.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.173 -0.467 . . . . 71.14 110.875 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.577 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -47.51 -34.91 8.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.185 -0.462 . . . . 64.21 111.143 -179.864 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -60.17 -44.24 95.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 71.13 110.953 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -63.87 113.47 3.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.088 -0.506 . . . . 73.44 110.886 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.06 -24.13 37.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 73.44 110.866 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -66.3 -57.4 7.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 64.51 110.895 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -57.61 -56.07 26.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 65.35 110.913 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -53.41 -31.32 18.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 71.42 111.128 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 7.8 mtm -68.35 -55.54 11.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.484 . . . . 73.44 110.863 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 48.2 mttt -54.53 -39.04 67.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.262 -0.426 . . . . 71.15 110.894 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.479 HD11 HG11 ' A' ' 69' ' ' VAL . 70.4 mt -65.71 -58.22 7.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 65.1 111.079 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.731 HG23 ' HB ' ' A' ' 86' ' ' ILE . 97.8 mt -57.79 -35.17 50.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 72.3 111.127 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -70.77 -52.01 23.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.153 -0.476 . . . . 44.45 110.836 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -61.28 -49.4 77.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 74.31 110.892 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -68.9 -14.5 63.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 74.51 110.881 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.65 55.57 4.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 72.15 110.902 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.731 ' HB ' HG23 ' A' ' 81' ' ' ILE . 39.0 mt -84.9 132.07 47.11 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 121.671 0.748 . . . . 63.45 111.16 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 151.33 68.78 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.634 2.223 . . . . 74.2 112.389 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -85.55 168.29 14.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.43 . . . . 73.15 111.167 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.619 HG23 ' O ' ' A' ' 31' ' ' HIS . 71.1 t -51.66 -58.12 2.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 63.04 111.108 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -52.02 -51.65 55.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 71.12 110.874 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 40.1 mm-40 -57.02 -41.07 77.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.156 -0.475 . . . . 45.4 110.878 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.446 ' O ' HG23 ' A' ' 96' ' ' THR . 34.8 t90 -66.93 -38.02 85.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.251 -0.431 . . . . 73.22 110.932 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -68.12 -35.47 78.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 73.44 110.926 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -71.79 -49.85 35.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 61.54 110.912 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.407 ' HG2' ' HA ' ' A' ' 92' ' ' TRP . 21.0 pt20 -61.03 -39.93 91.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 63.42 110.891 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.446 HG23 ' O ' ' A' ' 92' ' ' TRP . 38.8 p . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 52.54 111.157 -179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 . . . . . 0 C--O 1.231 0.113 0 CA-C-O 120.863 0.363 . . . . 72.35 110.863 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' -6' ' ' ILE . . . . . 0.466 HG23 ' OH ' ' A' ' 32' ' ' TYR . 3.0 mp -78.26 116.47 59.28 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.608 0.718 . . . . 73.42 111.141 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 -49.58 0.55 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.679 2.253 . . . . 64.4 112.366 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 1.2 t 49.61 32.36 4.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.46 . . . . 72.31 110.877 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -116.31 162.56 25.69 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.598 0.713 . . . . 74.22 110.872 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.68 -18.19 37.5 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.714 2.276 . . . . 73.11 112.355 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 65.92 146.15 0.1 OUTLIER Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.593 0.711 . . . . 70.13 111.08 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.79 153.49 68.72 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.674 2.249 . . . . 63.31 112.362 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 5.2 mtmp? -100.4 161.17 24.92 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.598 0.713 . . . . 60.3 110.894 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 165.31 31.38 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.664 2.243 . . . . 63.32 112.356 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--N 1.341 0.14 0 C-N-CA 122.678 2.252 . . . . 73.45 112.321 179.972 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.631 HD11 HD12 ' A' ' 28' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.816 0.341 . . . . 72.53 110.939 . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -130.15 150.65 51.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 72.45 110.866 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -135.04 144.86 47.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.154 -0.476 . . . . 41.14 111.102 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.67 HG23 ' O ' ' A' ' 24' ' ' GLU . 10.0 p -114.58 129.38 70.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 75.11 111.131 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.652 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -69.17 132.3 46.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.47 . . . . 50.33 111.119 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.753 HD11 ' HB2' ' A' ' 56' ' ' ARG . 3.8 mt -100.73 -20.94 15.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 74.22 110.918 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -129.25 168.62 15.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.472 . . . . 71.03 110.942 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -88.91 104.89 17.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.479 . . . . 73.22 110.899 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.409 ' HB3' HG12 ' A' ' 20' ' ' VAL . 16.7 t80 -91.46 104.42 16.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 72.04 110.886 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.6 mmtp -84.96 106.44 16.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 71.12 110.909 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.24 158.74 3.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.225 -0.443 . . . . 41.02 111.116 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -128.49 -39.2 1.68 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.23 -0.441 . . . . 62.23 110.863 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 16.0 mmm180 -108.28 178.86 4.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 74.24 110.854 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -67.27 -36.38 81.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.193 -0.458 . . . . 63.53 110.833 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -68.76 -49.14 61.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 73.15 110.903 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -57.04 135.45 56.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.22 -0.445 . . . . 63.45 110.88 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 18' ' ' LEU . 11.0 tp -112.13 129.77 56.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 62.33 110.91 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.01 142.1 45.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 74.3 110.846 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.783 HG21 HD11 ' A' ' 26' ' ' LEU . 6.4 p -152.82 144.61 15.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.198 -0.456 . . . . 62.22 111.135 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.3 m -105.47 160.52 25.77 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.668 0.746 . . . . 63.24 110.89 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 122.23 8.92 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.694 2.263 . . . . 72.44 112.38 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.09 5.53 30.53 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.765 -0.731 . . . . 70.12 112.473 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.67 ' O ' HG23 ' A' ' 5' ' ' VAL . 13.8 mt-10 -92.3 161.08 14.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.82 0.343 . . . . 74.43 110.91 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -107.83 127.03 53.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.195 -0.457 . . . . 75.22 110.894 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.783 HD11 HG21 ' A' ' 20' ' ' VAL . 2.1 mt -129.7 146.5 51.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 74.42 110.919 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.7 t -104.86 112.54 25.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 60.14 110.887 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.798 HG12 ' HB2' ' A' ' 39' ' ' ALA . 58.1 mt -81.92 145.41 8.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.128 -0.487 . . . . 73.1 111.147 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 80.8 m -117.27 -33.41 4.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 43.14 110.869 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -161.04 173.57 15.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 41.14 111.102 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.426 ' ND1' HD13 ' A' ' 81' ' ' ILE . 1.5 p80 -122.84 177.95 5.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 73.21 110.845 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -141.94 99.95 3.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 74.43 110.934 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.3 t0 54.61 22.82 4.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.087 -0.506 . . . . 74.45 110.911 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.625 ' HD2' HD12 ' A' ' 81' ' ' ILE . 37.1 m-85 63.74 15.42 8.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 63.24 110.925 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -103.46 -40.89 6.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.07 -0.514 . . . . 65.0 110.897 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.418 ' CZ2' ' HB2' ' B' ' -3' ' ' ARG . 91.1 m95 -122.24 164.22 18.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.194 -0.457 . . . . 74.54 110.902 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.755 ' CD2' HG22 ' A' ' 52' ' ' VAL . 1.3 m-85 -134.63 130.5 36.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 74.31 110.857 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.562 HG13 HG22 ' A' ' 89' ' ' VAL . 8.5 mm -92.39 94.29 4.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 65.45 111.146 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.798 ' HB2' HG12 ' A' ' 28' ' ' ILE . . . -124.59 164.49 19.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.191 -0.459 . . . . 71.54 111.099 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.9 pttm -127.43 157.25 73.42 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.521 0.677 . . . . 64.32 110.926 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 138.12 37.2 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.683 2.256 . . . . 72.24 112.32 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 60.5 mt . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 73.43 111.15 179.852 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 N--CA 1.466 -0.096 0 CA-C-O 120.871 0.279 . . . . 63.01 112.363 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -115.83 -130.71 4.72 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.702 -0.761 . . . . 73.24 112.487 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -144.18 127.05 16.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.861 0.363 . . . . 71.32 110.913 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.2 p -135.13 129.85 19.09 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.672 0.749 . . . . 74.35 111.135 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.68 161.72 44.82 Favored 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.677 2.251 . . . . 65.2 112.346 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.755 HG22 ' CD2' ' A' ' 37' ' ' PHE . 4.0 t -83.06 -21.74 8.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.238 -0.437 . . . . 71.53 111.139 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.2 m -75.98 -4.7 42.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.124 -0.489 . . . . 74.25 110.888 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -126.16 -0.82 7.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.128 -0.487 . . . . 65.42 110.939 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -125.37 147.87 29.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.144 -0.48 . . . . 73.14 111.133 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.753 ' HB2' HD11 ' A' ' 7' ' ' LEU . 15.7 ttp180 -123.63 110.6 15.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 73.43 110.814 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.406 ' O ' HG22 ' A' ' 57' ' ' ILE . 1.7 mp -65.76 111.44 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 74.45 111.146 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.654 HG23 ' HG2' ' A' ' 56' ' ' ARG . 3.5 pt -127.64 141.69 45.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 71.42 111.107 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -70.43 123.83 22.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 74.33 110.895 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.0 tp -56.35 -24.93 47.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 74.31 110.92 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.01 -29.38 16.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 64.35 110.878 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -143.09 78.49 15.14 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.618 0.723 . . . . 75.34 110.841 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.748 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.9 Cg_endo -69.76 -7.36 20.85 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.668 2.245 . . . . 73.31 112.339 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.11 -7.58 38.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.435 . . . . 74.5 111.047 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -84.4 -52.22 6.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.3 -0.409 . . . . 73.31 110.863 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.648 ' O ' HG12 ' A' ' 69' ' ' VAL . 12.9 m-85 -97.48 23.88 7.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 73.05 110.914 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.748 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -85.41 -19.2 31.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 74.04 111.118 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 90.4 p -92.58 -24.13 18.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.237 -0.438 . . . . 65.42 110.859 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 1.054 HG21 HD11 ' A' ' 80' ' ' ILE . 9.0 p -52.07 155.56 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.477 . . . . 74.0 111.14 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -110.61 94.98 5.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.195 -0.457 . . . . 75.03 110.871 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.742 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -58.44 -38.64 77.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.175 -0.466 . . . . 61.2 111.119 -179.867 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -55.1 -44.26 74.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.252 -0.431 . . . . 75.13 110.917 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -63.74 110.04 1.91 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.134 -0.485 . . . . 52.52 110.88 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.57 -28.69 21.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 62.53 110.878 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -66.97 -56.74 8.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 72.14 110.892 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -58.64 -55.15 38.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 74.11 110.89 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.55 ' HA ' HD12 ' A' ' 80' ' ' ILE . 5.5 p -53.92 -33.22 23.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 75.23 111.09 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 14.5 mtm -67.14 -53.5 30.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.231 -0.44 . . . . 72.23 110.834 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.1 mttm -56.18 -37.4 69.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 55.52 110.925 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 1.054 HD11 HG21 ' A' ' 69' ' ' VAL . 17.3 mt -66.77 -52.62 43.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 74.3 111.102 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.744 HG23 ' HB ' ' A' ' 86' ' ' ILE . 90.6 mt -63.25 -33.86 63.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 62.22 111.096 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -71.11 -46.2 62.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 71.0 110.885 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -68.53 -48.43 64.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.465 . . . . 63.01 110.844 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -68.75 -15.35 63.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.134 -0.485 . . . . 73.15 110.839 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt 59.95 49.56 7.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.147 -0.479 . . . . 52.14 110.884 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.744 ' HB ' HG23 ' A' ' 81' ' ' ILE . 24.5 mt -78.23 131.53 68.94 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.598 0.714 . . . . 71.54 111.177 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 164.32 34.97 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.701 2.268 . . . . 72.35 112.307 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -95.41 170.2 9.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.2 -0.455 . . . . 75.53 111.19 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.562 HG22 HG13 ' A' ' 38' ' ' ILE . 68.6 t -55.81 -54.65 24.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.272 -0.422 . . . . 63.05 111.122 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -51.95 -50.58 60.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 60.13 110.893 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -57.74 -44.39 86.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.489 . . . . 73.22 110.894 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 23.0 t90 -61.68 -43.0 99.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.208 -0.451 . . . . 73.21 110.921 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 5.1 mmpt? -60.65 -53.25 59.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 65.22 110.884 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -59.98 -37.82 80.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 74.35 110.904 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -61.06 -53.03 62.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.481 . . . . 73.21 110.904 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 53.12 111.15 -179.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 . . . . . 0 C--O 1.231 0.119 0 CA-C-O 120.826 0.346 . . . . 71.3 110.948 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 26.8 mm 53.06 76.31 0.54 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.653 0.739 . . . . 65.14 111.163 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.67 78.42 0.98 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.704 2.269 . . . . 63.32 112.386 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 14.5 t -81.13 -0.52 40.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 54.31 110.824 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' -3' ' ' ARG . . . . . 0.418 ' HB2' ' CZ2' ' A' ' 36' ' ' TRP . 24.5 mmt180 -48.91 161.21 0.43 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.575 0.702 . . . . 74.23 110.874 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 -26.21 27.62 Favored 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.677 2.251 . . . . 64.11 112.344 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.29 85.84 0.15 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.591 0.71 . . . . 72.35 111.08 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 158.38 57.09 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.622 2.215 . . . . 75.53 112.367 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.94 160.45 33.79 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.582 0.706 . . . . 75.12 110.894 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 167.48 24.34 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.674 2.25 . . . . 74.52 112.345 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--N 1.342 0.195 0 C-N-CA 122.645 2.23 . . . . 62.11 112.37 179.95 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.697 HD11 HG13 ' A' ' 28' ' ' ILE . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.846 0.355 . . . . 74.0 110.937 . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -123.26 142.84 50.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.466 . . . . 70.33 110.875 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -122.76 150.49 42.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 70.42 111.057 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.1 p -116.07 129.08 73.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.176 -0.465 . . . . 65.2 111.127 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.707 HG21 ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -68.39 132.46 47.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.453 . . . . 63.44 111.153 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.779 HD11 ' HB2' ' A' ' 56' ' ' ARG . 7.1 mt -102.71 -16.81 15.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.208 -0.451 . . . . 64.42 110.909 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -136.49 161.99 34.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.474 . . . . 64.45 110.924 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -86.87 114.26 23.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.086 -0.506 . . . . 61.52 110.865 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -100.2 130.08 46.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.115 -0.493 . . . . 73.23 110.88 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -104.21 109.36 21.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.12 -0.491 . . . . 65.11 110.913 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.478 ' HB1' ' HB3' ' A' ' 17' ' ' GLU . . . -62.86 159.58 16.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 71.31 111.114 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -116.57 -28.44 6.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 74.24 110.89 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -141.46 -174.52 4.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 74.3 110.846 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -64.71 -39.19 93.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.172 -0.467 . . . . 73.43 110.824 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -62.86 -18.4 62.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.222 -0.445 . . . . 71.21 110.85 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.478 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 0.4 OUTLIER -110.2 140.12 44.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 73.33 110.912 -179.904 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . 0.434 ' C ' ' HB2' ' A' ' 12' ' ' ALA . 4.6 tp -114.57 153.77 29.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 74.44 110.898 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -97.78 126.77 43.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.476 . . . . 62.34 110.864 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.707 ' HB ' HG21 ' A' ' 6' ' ' THR . 0.2 OUTLIER -125.51 159.29 33.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.246 -0.433 . . . . 72.21 111.16 179.955 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.4 m -124.27 159.25 58.01 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.654 0.74 . . . . 45.44 110.799 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 118.48 5.71 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.656 2.238 . . . . 73.22 112.329 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.02 -0.34 31.6 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.758 -0.734 . . . . 63.25 112.504 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -89.25 151.37 22.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.863 0.363 . . . . 74.44 110.888 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.568 ' CB ' HD12 ' A' ' 42' ' ' ILE . 10.5 m120 -96.61 112.63 24.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.136 -0.483 . . . . 65.43 110.881 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.754 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 3.1 mm? -112.25 142.04 45.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.193 -0.458 . . . . 64.21 110.905 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.72 112.48 24.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 60.44 110.85 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.697 HG13 HD11 ' A' ' 2' ' ' LEU . 31.3 mm -66.94 144.89 14.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 71.42 111.117 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.5 m -122.46 -42.09 2.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.169 -0.469 . . . . 62.14 110.904 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.409 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -171.77 168.97 6.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 62.54 111.117 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.442 ' CE1' HG21 ' A' ' 81' ' ' ILE . 2.1 p80 -119.45 178.31 4.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 65.43 110.861 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -148.69 105.7 3.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 65.14 110.854 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 56.54 22.52 6.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.084 -0.507 . . . . 74.31 110.866 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.614 ' HD2' HD12 ' A' ' 81' ' ' ILE . 16.5 m-85 57.78 22.78 8.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 72.54 110.939 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -121.06 -5.47 9.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.119 -0.491 . . . . 70.23 110.935 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.555 ' HB3' HD11 ' A' ' 49' ' ' LEU . 98.7 m95 -152.51 158.8 43.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.11 -0.495 . . . . 74.11 110.89 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.601 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.5 OUTLIER -141.55 151.67 43.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.458 . . . . 71.12 110.888 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.42 ' CD1' HD22 ' A' ' 49' ' ' LEU . 6.3 mm -109.49 94.03 2.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.191 -0.459 . . . . 71.12 111.121 179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.754 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -107.25 146.03 31.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 75.24 111.159 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -118.0 155.56 51.07 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.584 0.706 . . . . 64.52 110.93 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 123.7 10.35 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.66 2.24 . . . . 73.22 112.329 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.568 HD12 ' CB ' ' A' ' 25' ' ' ASN . 69.5 mt . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 70.24 111.123 179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 N--CA 1.465 -0.164 0 CA-C-O 120.831 0.263 . . . . 54.01 112.365 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -129.71 -146.44 6.04 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.739 -0.743 . . . . 53.22 112.477 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.555 HD11 ' HB3' ' A' ' 36' ' ' TRP . 0.1 OUTLIER -137.04 124.75 22.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.828 0.347 . . . . 64.13 110.889 -179.932 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.424 ' N ' HD13 ' A' ' 49' ' ' LEU . 14.5 p -134.26 132.25 21.0 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.636 0.731 . . . . 71.33 111.109 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.665 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.6 Cg_endo -69.8 158.36 57.19 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.677 2.251 . . . . 53.5 112.328 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.922 HG11 HG21 ' A' ' 77' ' ' VAL . 2.7 t -76.3 -20.86 15.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 75.41 111.128 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.4 m -79.71 0.95 28.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 73.44 110.856 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.407 ' HB2' ' HG2' ' A' ' 51' ' ' PRO . 7.5 m-85 -118.75 -27.13 5.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.145 -0.48 . . . . 75.41 110.959 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.665 HG22 ' O ' ' A' ' 51' ' ' PRO . 13.1 m -106.23 147.9 11.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.081 -0.508 . . . . 43.44 111.123 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.779 ' HB2' HD11 ' A' ' 7' ' ' LEU . 15.4 ttp180 -117.66 110.9 18.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 55.2 110.874 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.42 ' O ' HG22 ' A' ' 57' ' ' ILE . 1.6 mp -68.76 112.39 3.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 53.4 111.125 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.66 HG23 ' HG2' ' A' ' 56' ' ' ARG . 7.1 pt -125.22 167.16 19.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.455 . . . . 74.25 111.171 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -102.42 125.39 49.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 62.21 110.895 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.3 mt -56.22 -24.7 43.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 63.24 110.951 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.75 -29.92 18.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.15 -0.477 . . . . 73.14 110.856 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -145.92 74.74 13.27 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.596 0.712 . . . . 63.44 110.898 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.669 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.4 Cg_endo -69.76 -8.83 24.61 Favored 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.711 2.274 . . . . 73.41 112.359 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.96 -5.9 36.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 54.43 111.078 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.2 ttmm -84.1 -51.97 6.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 73.34 110.884 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -90.67 -0.08 57.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.444 . . . . 75.52 110.895 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.669 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -61.3 -17.86 55.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 62.03 111.12 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 86.2 p -76.62 -24.16 53.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.25 -0.432 . . . . 52.53 110.817 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.7 HG12 ' H ' ' A' ' 71' ' ' THR . 14.2 t -77.77 121.76 31.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 74.24 111.11 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -90.25 11.68 20.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 65.35 110.835 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.858 ' HB ' HG12 ' A' ' 52' ' ' VAL . 2.0 p 45.91 33.7 1.69 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.471 . . . . 75.52 111.163 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -104.12 -54.83 2.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 73.05 110.951 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.86 115.44 4.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 75.02 110.812 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.04 -28.99 19.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.457 . . . . 73.03 110.896 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -66.61 -49.04 67.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 74.0 110.909 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -62.95 -57.0 12.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 74.51 110.961 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.922 HG21 HG11 ' A' ' 52' ' ' VAL . 1.7 p -54.31 -31.7 22.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 63.14 111.162 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 11.5 mtm -67.91 -54.11 21.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.492 . . . . 63.44 110.844 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 34.8 mttt -57.55 -35.79 70.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 73.35 110.901 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.516 HD11 HG11 ' A' ' 69' ' ' VAL . 41.8 mt -67.71 -50.47 60.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 71.14 111.118 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.725 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.4 mt -65.64 -35.7 75.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 65.41 111.084 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -71.21 -52.05 21.24 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 72.3 110.886 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -58.57 -52.69 64.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.185 -0.461 . . . . 73.32 110.923 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -67.95 -15.51 63.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 72.1 110.885 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.8 mmtm 60.94 54.98 3.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.486 . . . . 53.42 110.942 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.725 ' HB ' HG23 ' A' ' 81' ' ' ILE . 21.2 mt -82.25 131.3 56.52 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.622 0.725 . . . . 63.11 111.129 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.409 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 54.5 Cg_endo -69.72 162.81 40.59 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.654 2.236 . . . . 73.23 112.346 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.19 171.48 7.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.196 -0.456 . . . . 64.04 111.13 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 85.8 t -51.94 -53.98 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 61.41 111.148 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 69.2 mt-10 -51.68 -51.99 51.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 73.52 110.853 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 60.4 mm-40 -59.21 -43.88 92.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.446 . . . . 44.42 110.939 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 32.9 t90 -62.61 -38.75 91.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 71.51 110.893 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 5.8 mmpt? -64.95 -52.8 54.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 63.32 110.867 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.23 -41.92 85.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.234 -0.439 . . . . 71.31 110.879 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -63.09 -46.44 87.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.225 -0.443 . . . . 65.45 110.947 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.1 p . . . . . 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.451 . . . . 71.31 111.152 -179.925 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 . . . . . 0 C--O 1.232 0.156 0 CA-C-O 120.782 0.325 . . . . 64.31 110.857 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 22.0 mm 56.48 77.88 0.4 Allowed Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.663 0.744 . . . . 63.23 111.16 -179.962 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.82 86.9 0.57 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.635 2.223 . . . . 73.25 112.365 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 13.2 t -80.4 -1.39 41.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.456 . . . . 75.53 110.862 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' -3' ' ' ARG . . . . . 0.406 ' HB2' ' CZ2' ' A' ' 36' ' ' TRP . 0.0 OUTLIER -49.92 163.2 0.43 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.628 0.727 . . . . 74.25 110.85 -179.96 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 -22.64 31.87 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.686 2.258 . . . . 74.34 112.385 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.63 84.07 0.19 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.577 0.703 . . . . 74.2 111.135 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 163.24 38.97 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.721 2.28 . . . . 74.31 112.368 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -100.14 160.47 27.02 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.601 0.715 . . . . 62.23 110.879 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 163.84 36.77 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.691 2.261 . . . . 51.41 112.339 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 C--N 1.341 0.148 0 C-N-CA 122.702 2.268 . . . . 61.13 112.319 179.94 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.12 0 CA-C-O 120.891 0.376 . . . . 74.03 110.913 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.724 ' CE1' HD12 ' A' ' 60' ' ' LEU . 12.7 m-85 -116.8 163.9 15.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.469 . . . . 65.1 110.93 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -142.91 164.02 31.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 72.22 111.099 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 24' ' ' GLU . 10.9 p -130.71 130.89 64.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 61.02 111.143 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.606 HG21 ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -72.86 139.6 47.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 74.44 111.09 -179.931 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.683 HD11 ' HB2' ' A' ' 56' ' ' ARG . 23.3 mt -114.07 -11.22 12.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 64.32 110.915 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -137.01 159.63 41.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 71.31 110.892 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -85.74 108.85 18.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 75.53 110.871 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -93.63 139.28 30.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 75.25 110.855 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -112.97 97.1 6.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.118 -0.492 . . . . 54.43 110.927 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.67 157.36 1.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.451 . . . . 72.12 111.108 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -115.82 -32.97 5.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 70.4 110.894 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -133.11 -178.45 4.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 72.32 110.886 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -63.47 -41.34 98.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.207 -0.451 . . . . 71.11 110.832 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -57.32 -23.68 50.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.211 -0.45 . . . . 63.03 110.901 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.0 152.23 19.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 55.13 110.908 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.2 tt -131.77 120.55 22.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.138 -0.483 . . . . 64.34 110.945 -179.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -63.73 143.62 57.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.235 -0.439 . . . . 74.54 110.836 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.606 ' HB ' HG21 ' A' ' 6' ' ' THR . 0.9 OUTLIER -139.95 159.11 26.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 72.33 111.144 -179.984 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.3 m -121.44 158.07 54.57 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.671 0.748 . . . . 73.21 110.861 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.72 117.96 5.39 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.709 2.273 . . . . 74.33 112.375 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.06 4.66 31.14 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.737 -0.744 . . . . 55.04 112.448 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.531 ' O ' HG23 ' A' ' 5' ' ' VAL . 39.5 mm-40 -92.12 154.59 18.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.85 0.357 . . . . 74.44 110.869 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -105.61 115.82 30.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 63.34 110.92 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.731 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 3.7 mp -116.55 155.35 28.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.201 -0.454 . . . . 62.45 110.938 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.5 t -108.26 112.79 25.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 73.04 110.895 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 57.4 mt -75.72 144.86 11.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 64.0 111.146 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.8 m -116.23 -43.94 2.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.144 -0.48 . . . . 72.41 110.924 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.52 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -161.02 174.8 13.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 54.31 111.115 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.439 ' CE1' HG21 ' A' ' 81' ' ' ILE . 3.3 p80 -121.18 177.95 4.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 75.52 110.829 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.431 ' HB3' ' HB2' ' A' ' 36' ' ' TRP . 20.2 t80 -146.87 100.83 3.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.206 -0.452 . . . . 71.42 110.91 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.416 ' HB3' ' HG2' ' A' ' 35' ' ' GLU . 33.6 t0 59.97 17.5 6.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.098 -0.501 . . . . 64.22 110.905 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.575 ' HD2' HD12 ' A' ' 81' ' ' ILE . 41.3 m-85 63.47 29.65 15.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.169 -0.469 . . . . 72.3 110.939 -179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.416 ' HG2' ' HB3' ' A' ' 33' ' ' ASP . 4.4 pt-20 -131.16 -1.76 4.02 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.101 -0.499 . . . . 64.54 110.921 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.448 ' HB3' HD21 ' A' ' 49' ' ' LEU . 88.1 m95 -152.73 135.52 15.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.107 -0.497 . . . . 74.14 110.905 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.581 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.5 OUTLIER -121.78 131.38 54.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.259 -0.428 . . . . 75.12 110.871 -179.951 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.4 mm -87.04 94.55 4.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 71.35 111.154 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.731 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -111.1 138.99 46.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 74.43 111.106 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 51.2 pttt -112.82 153.67 45.07 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.55 0.69 . . . . 72.32 110.903 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 119.56 6.49 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.664 2.243 . . . . 65.3 112.394 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.4 mt . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 72.24 111.16 179.911 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo . . . . . 0 C--O 1.23 0.113 0 CA-C-O 120.803 0.251 . . . . 73.44 112.348 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -105.6 -106.47 3.12 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.752 -0.737 . . . . 72.51 112.455 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.448 HD21 ' HB3' ' A' ' 36' ' ' TRP . 1.3 tt -163.55 124.73 2.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.837 0.351 . . . . 72.25 110.935 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.453 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.3 p -137.56 133.8 18.15 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.658 0.742 . . . . 72.23 111.074 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.453 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.9 Cg_endo -69.78 153.85 68.36 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.661 2.241 . . . . 75.02 112.355 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.822 HG12 ' HB ' ' A' ' 71' ' ' THR . 4.9 t -72.59 -21.01 19.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 64.32 111.148 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.0 m -77.0 -2.58 34.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 71.11 110.837 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.441 ' O ' HG22 ' A' ' 6' ' ' THR . 37.7 m-85 -127.22 22.8 6.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.107 -0.497 . . . . 64.3 110.881 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.616 HG22 ' HA ' ' A' ' 52' ' ' VAL . 10.7 m -148.63 163.23 5.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.119 -0.491 . . . . 72.22 111.155 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.686 ' HG2' HG23 ' A' ' 58' ' ' ILE . 26.1 ttm180 -130.57 119.09 21.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.461 . . . . 73.43 110.883 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 43.2 mm -70.13 108.8 2.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.456 . . . . 72.54 111.152 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.686 HG23 ' HG2' ' A' ' 56' ' ' ARG . 1.4 pt -134.18 132.82 55.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 73.12 111.15 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -67.34 145.77 54.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 63.32 110.868 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.724 HD12 ' CE1' ' A' ' 3' ' ' PHE . 0.4 OUTLIER -71.31 -36.67 71.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 73.12 110.911 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.24 -24.49 32.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 74.31 110.898 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -148.76 74.17 10.34 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.607 0.717 . . . . 62.11 110.904 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.677 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.7 Cg_endo -69.74 -8.57 23.95 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.688 2.259 . . . . 62.43 112.331 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.46 -18.46 23.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 72.55 111.113 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.8 ttmt -74.62 -50.32 18.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 73.12 110.921 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.536 ' O ' HG12 ' A' ' 69' ' ' VAL . 65.5 m-85 -95.25 23.27 5.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 75.31 110.939 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.677 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -89.48 11.71 18.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.13 -0.486 . . . . 53.53 111.11 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.7 p -114.87 -24.04 8.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 72.52 110.869 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.536 HG12 ' O ' ' A' ' 66' ' ' TYR . 7.9 p -55.18 140.24 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.145 -0.48 . . . . 54.01 111.134 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . 0.407 ' H ' ' NE2' ' A' ' 76' ' ' GLN . 31.4 m-20 -99.44 93.72 6.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 72.43 110.887 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.822 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -50.84 -30.15 13.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 70.41 111.127 -179.884 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -57.38 -51.02 71.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 72.42 110.876 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -63.99 110.11 2.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.172 -0.467 . . . . 70.32 110.824 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -24.29 39.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 74.45 110.865 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -66.87 -52.96 37.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 74.32 110.858 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.602 ' O ' HD12 ' A' ' 80' ' ' ILE . 4.4 mt-30 -60.15 -58.45 8.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 75.01 110.943 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.519 HG21 HG11 ' A' ' 52' ' ' VAL . 2.6 p -51.63 -32.27 13.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 73.35 111.162 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.8 mtm -68.16 -51.73 42.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 70.04 110.93 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.1 mttm -55.39 -47.07 76.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.209 -0.451 . . . . 74.22 110.94 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.602 HD12 ' O ' ' A' ' 76' ' ' GLN . 1.7 mp -60.98 -53.73 45.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 71.32 111.153 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.575 HD12 ' HD2' ' A' ' 34' ' ' TYR . 82.0 mt -57.35 -36.05 51.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.154 -0.476 . . . . 51.54 111.138 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -71.16 -51.9 22.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 75.51 110.883 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -59.14 -49.4 78.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.445 . . . . 74.33 110.924 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -67.9 -15.88 63.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 75.55 110.868 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 29.6 mmtm 61.31 49.51 5.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 75.43 110.873 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.565 ' HB ' HG23 ' A' ' 81' ' ' ILE . 38.2 mt -79.14 125.16 84.04 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.598 0.714 . . . . 61.23 111.158 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.52 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 54.0 Cg_endo -69.68 168.72 20.63 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.699 2.266 . . . . 63.4 112.342 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.77 167.04 14.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 42.45 111.125 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.689 HG12 ' CE ' ' A' ' 93' ' ' LYS . 96.2 t -51.04 -58.88 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.205 -0.452 . . . . 74.43 111.139 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -51.28 -48.04 62.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.481 . . . . 73.05 110.877 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -56.8 -33.48 66.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.465 . . . . 75.42 110.886 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 22.3 t90 -66.78 -41.01 88.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.241 -0.436 . . . . 75.01 110.888 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.689 ' CE ' HG12 ' A' ' 89' ' ' VAL . 16.7 mtmt -67.4 -49.32 64.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 73.24 110.915 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -61.6 -39.7 92.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 55.14 110.836 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -65.27 -48.84 71.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 72.51 110.937 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 3.6 p . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 75.01 111.141 -179.958 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.823 0.344 . . . . 65.12 110.898 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 28.8 mm 50.1 78.18 0.42 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.612 0.72 . . . . 70.31 111.149 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 88.75 0.53 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.689 2.259 . . . . 72.24 112.356 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 36.8 p -78.6 -2.8 40.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 55.23 110.839 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' -3' ' ' ARG . . . . . 0.445 ' HB2' ' CZ2' ' A' ' 36' ' ' TRP . 22.3 mmm-85 -49.92 160.53 0.63 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.616 0.722 . . . . 75.54 110.853 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 -19.27 36.61 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.673 2.249 . . . . 54.43 112.337 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.54 84.29 0.18 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.596 0.712 . . . . 72.01 111.135 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.66 160.06 51.14 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.717 2.278 . . . . 73.51 112.365 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.75 160.47 27.8 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.543 0.687 . . . . 54.13 110.884 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 167.28 24.91 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.658 2.238 . . . . 72.42 112.338 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo . . . . . 0 C--N 1.342 0.193 0 C-N-CA 122.705 2.27 . . . . 62.31 112.313 179.984 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.642 HD12 ' HB ' ' A' ' 28' ' ' ILE . 0.1 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.833 0.349 . . . . 72.43 110.899 . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.462 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 73.9 m-85 -140.89 139.8 34.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 75.22 110.889 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.698 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -128.22 159.61 34.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.113 -0.494 . . . . 64.34 111.094 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 24' ' ' GLU . 6.1 p -127.75 120.9 55.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.259 -0.428 . . . . 73.32 111.166 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.702 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -62.98 128.48 36.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 71.2 111.143 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.501 HD11 ' HB2' ' A' ' 56' ' ' ARG . 33.9 mt -101.57 -15.54 17.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.225 -0.443 . . . . 64.52 110.927 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -137.51 157.68 46.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 75.54 110.948 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -80.08 105.09 11.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.099 -0.5 . . . . 72.4 110.925 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -93.55 101.08 13.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 61.34 110.887 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.34 121.54 25.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.474 . . . . 75.5 110.915 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.59 146.84 52.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 71.32 111.095 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -116.34 -26.63 7.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.238 -0.437 . . . . 75.22 110.853 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -124.36 178.53 5.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 74.41 110.862 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -68.8 -26.71 65.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.192 -0.458 . . . . 71.01 110.849 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -77.36 -31.56 54.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 73.44 110.898 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -74.36 148.49 41.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 72.42 110.907 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.7 tp -122.31 134.79 54.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.191 -0.459 . . . . 65.14 110.906 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -80.41 132.44 35.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.444 . . . . 75.34 110.852 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.702 ' CG1' HG21 ' A' ' 6' ' ' THR . 9.7 p -146.38 147.05 18.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 71.53 111.115 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.3 m -107.83 160.27 27.42 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.667 0.746 . . . . 73.2 110.849 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 125.91 12.68 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.7 2.266 . . . . 74.34 112.315 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.05 1.5 31.7 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.777 -0.725 . . . . 50.11 112.523 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.426 ' O ' HG23 ' A' ' 5' ' ' VAL . 6.5 mm-40 -92.23 163.85 13.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.854 0.359 . . . . 64.42 110.927 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -113.19 122.02 46.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 64.32 110.879 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.797 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 2.3 mm? -117.1 151.69 36.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 75.0 110.925 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.78 112.58 24.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.469 . . . . 74.24 110.886 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.698 HD11 ' HB2' ' A' ' 4' ' ' ALA . 68.9 mt -77.88 143.35 12.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.107 -0.497 . . . . 71.44 111.124 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -118.94 -41.74 2.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.159 -0.473 . . . . 53.5 110.883 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.438 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -158.95 174.17 15.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.231 -0.441 . . . . 72.13 111.111 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.553 ' ND1' HD13 ' A' ' 81' ' ' ILE . 1.7 p80 -127.71 178.84 5.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.449 . . . . 64.42 110.869 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -138.34 100.25 4.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 75.32 110.895 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 45.9 t0 54.98 25.49 6.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 71.1 110.856 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.624 ' HD2' HD12 ' A' ' 81' ' ' ILE . 24.7 m-85 63.86 16.03 9.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.244 -0.435 . . . . 72.23 110.927 -179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.567 ' O ' HG23 ' A' ' 52' ' ' VAL . 28.9 mm-40 -103.46 -50.04 3.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 75.35 110.866 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 81.6 m95 -112.42 164.64 13.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.12 -0.491 . . . . 73.44 110.923 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.696 ' CD1' HG22 ' A' ' 52' ' ' VAL . 3.3 m-85 -138.23 155.94 48.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 73.54 110.884 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 11.5 mm -113.94 94.29 3.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.133 -0.485 . . . . 70.01 111.079 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.797 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -108.28 146.69 32.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 54.13 111.078 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.3 mttm -115.79 153.91 48.09 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.571 0.701 . . . . 72.42 110.886 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 118.67 5.82 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.664 2.242 . . . . 61.31 112.311 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 30.6 mt . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.189 -0.46 . . . . 54.23 111.149 179.882 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 N--CA 1.466 -0.143 0 CA-C-O 120.825 0.26 . . . . 73.42 112.329 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -117.86 -131.27 4.44 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.752 -0.737 . . . . 71.24 112.488 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.4 HD23 ' HD2' ' B' ' -7' ' ' PHE . 0.0 OUTLIER -146.04 128.35 15.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.845 0.355 . . . . 71.11 110.91 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.7 p -142.98 131.06 11.23 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.616 0.722 . . . . 73.24 111.146 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.662 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.4 Cg_endo -69.82 163.0 39.96 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.698 2.266 . . . . 75.1 112.283 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.78 HG12 ' HB ' ' A' ' 71' ' ' THR . 9.6 t -69.88 -21.64 24.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.221 -0.445 . . . . 74.24 111.155 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.2 m -80.48 -0.23 36.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.145 -0.48 . . . . 74.45 110.83 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -124.36 12.88 8.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.132 -0.486 . . . . 74.2 110.945 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.662 HG22 ' O ' ' A' ' 51' ' ' PRO . 10.3 m -152.84 139.27 12.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 73.22 111.164 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.557 ' HG2' HG23 ' A' ' 58' ' ' ILE . 19.6 ttm180 -112.08 119.74 39.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 73.05 110.861 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 16.5 mm -66.54 109.29 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 75.15 111.162 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.557 HG23 ' HG2' ' A' ' 56' ' ' ARG . 1.2 pt -131.6 128.19 60.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.466 . . . . 45.44 111.157 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.72 126.28 27.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 74.22 110.89 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.462 HD22 ' CZ ' ' A' ' 3' ' ' PHE . 17.1 tp -58.26 -29.77 66.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 73.4 110.941 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 9.0 mmt -88.64 -1.45 58.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 74.42 110.849 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -170.88 82.6 0.53 Allowed Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.602 0.715 . . . . 75.33 110.909 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.739 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 54.0 Cg_endo -69.72 -7.12 20.23 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.678 2.252 . . . . 74.21 112.398 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -100.69 -2.64 32.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 71.13 111.14 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.3 ttpt -81.58 -52.55 7.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 72.44 110.888 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.554 ' O ' HG12 ' A' ' 69' ' ' VAL . 32.8 m-85 -104.24 23.51 12.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.271 -0.422 . . . . 74.14 110.934 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.739 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -79.88 -18.24 51.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 72.45 111.117 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.8 p -106.12 22.85 15.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 63.11 110.875 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 1.05 HG21 HD11 ' A' ' 80' ' ' ILE . 8.0 p -90.86 149.2 4.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.15 -0.477 . . . . 74.01 111.165 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -98.61 83.85 3.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 62.35 110.87 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.78 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.1 OUTLIER -51.25 -44.57 61.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 61.33 111.113 -179.883 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -54.15 -40.63 67.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 73.13 110.943 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 61.4 t0 -63.71 107.34 1.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.491 . . . . 73.02 110.843 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.7 -28.56 22.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 61.23 110.831 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -66.89 -56.26 11.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 53.45 110.874 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -59.25 -56.1 26.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 65.43 110.908 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.5 p -53.14 -32.12 18.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 75.34 111.135 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 12.2 mtm -67.47 -54.55 19.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 72.44 110.887 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.6 mttp -55.63 -39.28 70.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.445 . . . . 72.11 110.906 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 1.05 HD11 HG21 ' A' ' 69' ' ' VAL . 83.3 mt -64.34 -54.9 25.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 71.04 111.156 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.782 HG23 ' HB ' ' A' ' 86' ' ' ILE . 97.1 mt -59.91 -35.36 60.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 74.42 111.166 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -69.09 -49.38 57.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.175 -0.466 . . . . 60.43 110.894 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -62.23 -43.57 98.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 73.33 110.879 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -75.5 -18.23 59.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 71.44 110.857 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 60.1 mmtt 63.18 49.53 3.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 72.42 110.904 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.782 ' HB ' HG23 ' A' ' 81' ' ' ILE . 21.1 mt -77.33 129.65 77.02 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.618 0.723 . . . . 64.13 111.156 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.438 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 54.2 Cg_endo -69.74 163.29 38.8 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.704 2.269 . . . . 74.4 112.356 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.85 166.17 12.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.248 -0.433 . . . . 72.1 111.108 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 91.4 t -50.66 -54.58 9.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 65.34 111.128 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -51.34 -49.11 62.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.173 -0.467 . . . . 61.42 110.917 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -56.98 -46.47 82.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 52.45 110.919 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -59.14 -37.79 78.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.228 -0.442 . . . . 74.21 110.91 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.09 -43.53 82.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.231 -0.44 . . . . 75.41 110.892 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -65.5 -36.07 82.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.263 -0.426 . . . . 73.53 110.858 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -72.96 -38.0 66.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 70.31 110.913 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 5.9 p . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 64.32 111.168 -179.929 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' -7' ' ' PHE . . . . . 0.4 ' HD2' HD23 ' A' ' 49' ' ' LEU . 31.8 m-85 . . . . . 0 C--O 1.231 0.125 0 CA-C-O 120.783 0.325 . . . . 71.41 110.845 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 31.2 mm 51.18 81.42 0.26 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.649 0.738 . . . . 62.22 111.146 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 81.7 0.81 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.676 2.251 . . . . 61.54 112.323 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 40.6 t -89.06 3.0 53.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.24 -0.436 . . . . 74.01 110.84 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -50.97 162.83 0.55 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.606 0.717 . . . . 64.45 110.836 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 -23.05 31.36 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.684 2.256 . . . . 51.03 112.344 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.01 90.49 0.09 OUTLIER Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.583 0.706 . . . . 71.02 111.07 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 158.41 57.0 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.71 2.273 . . . . 63.32 112.311 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.97 150.38 40.47 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.566 0.698 . . . . 72.55 110.926 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 166.21 28.36 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.622 2.214 . . . . 73.12 112.358 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--O 1.231 0.168 0 C-N-CA 122.656 2.237 . . . . 75.5 112.342 179.976 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.447 HD11 ' HB ' ' A' ' 28' ' ' ILE . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.123 0 CA-C-O 120.835 0.35 . . . . 74.11 110.932 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.599 ' HB2' HD23 ' A' ' 60' ' ' LEU . 68.0 m-85 -139.49 163.42 32.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 75.1 110.887 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.504 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -134.44 167.15 21.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.149 -0.478 . . . . 53.21 111.098 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.3 p -128.51 128.86 68.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 74.32 111.157 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.693 HG21 HG11 ' A' ' 20' ' ' VAL . 0.7 OUTLIER -72.16 138.42 47.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 63.43 111.132 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.632 HD11 ' HB2' ' A' ' 56' ' ' ARG . 18.0 mt -114.47 -15.39 12.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.229 -0.441 . . . . 62.35 110.956 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -137.42 158.35 44.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.139 -0.482 . . . . 73.1 110.927 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -83.04 104.83 13.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.1 -0.5 . . . . 64.35 110.874 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -88.96 103.81 16.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.192 -0.458 . . . . 73.13 110.892 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.1 mttm -79.4 112.05 16.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 62.34 110.918 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.616 ' HB1' ' HB2' ' A' ' 17' ' ' GLU . . . -71.85 163.11 28.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.237 -0.438 . . . . 63.05 111.122 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -119.01 -31.46 4.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.456 . . . . 73.44 110.909 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.1 mmm-85 -139.38 -174.76 3.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 55.15 110.814 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -64.54 -39.93 94.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 45.42 110.823 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.41 -28.0 40.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.194 -0.457 . . . . 73.32 110.87 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.616 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 40.0 mm-40 -88.98 -178.16 5.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 74.42 110.909 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 56.6 tp -150.41 123.18 8.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.122 -0.49 . . . . 60.24 110.912 -179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -80.53 124.52 29.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.214 -0.448 . . . . 72.35 110.913 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.693 HG11 HG21 ' A' ' 6' ' ' THR . 7.4 p -139.53 155.06 25.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.441 . . . . 62.3 111.123 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.0 m -111.11 159.34 33.08 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.65 0.738 . . . . 75.22 110.829 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 123.01 9.67 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.642 2.228 . . . . 72.41 112.32 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.41 -3.32 32.81 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.775 -0.726 . . . . 61.05 112.488 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -89.98 145.7 24.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.891 0.377 . . . . 75.31 110.874 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -86.67 142.06 28.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 75.31 110.842 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.54 HD11 HG21 ' A' ' 20' ' ' VAL . 5.3 mp -144.46 151.91 39.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.466 . . . . 71.41 110.922 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.5 t -107.08 125.56 51.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 64.13 110.876 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.504 HD11 ' HB2' ' A' ' 4' ' ' ALA . 53.5 mt -86.06 143.97 10.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 71.53 111.146 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 23.5 m -112.55 -37.72 4.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.18 -0.464 . . . . 74.05 110.922 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -164.27 176.16 9.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 74.51 111.129 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.428 ' CE1' HG21 ' A' ' 81' ' ' ILE . 1.6 p80 -126.61 178.26 6.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 74.41 110.876 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.73 ' OH ' HG23 ' B' ' -6' ' ' ILE . 40.5 t80 -141.03 99.65 3.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.211 -0.45 . . . . 72.25 110.903 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 54.92 24.01 5.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.129 -0.487 . . . . 62.01 110.858 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.593 ' HD2' HD12 ' A' ' 81' ' ' ILE . 35.7 m-85 63.6 15.3 8.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.201 -0.454 . . . . 75.03 110.92 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.431 ' O ' HG23 ' A' ' 52' ' ' VAL . 22.0 mm-40 -103.32 -49.17 3.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.498 . . . . 74.43 110.896 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -114.52 146.16 41.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 70.41 110.918 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.726 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -119.18 149.11 42.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.435 . . . . 75.34 110.897 -179.965 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.2 mm -108.53 96.27 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 74.25 111.103 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.464 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -105.71 161.62 14.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 73.2 111.133 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -136.59 158.32 73.45 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.534 0.683 . . . . 71.14 110.879 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.79 131.87 22.1 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.689 2.26 . . . . 64.31 112.372 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 27.0 mm . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.446 . . . . 75.13 111.104 179.945 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 C--O 1.231 0.139 0 CA-C-O 120.813 0.255 . . . . 63.4 112.337 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -126.19 -105.34 1.44 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.719 -0.753 . . . . 62.21 112.447 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -162.63 125.69 2.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.85 0.357 . . . . 63.25 110.896 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.413 HG23 ' HD2' ' A' ' 51' ' ' PRO . 10.0 p -136.51 132.99 18.95 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.583 0.706 . . . . 74.42 111.107 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.51 ' O ' HG22 ' A' ' 55' ' ' VAL . 54.0 Cg_endo -69.74 144.87 55.53 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.686 2.257 . . . . 61.41 112.347 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.726 HG22 ' CD2' ' A' ' 37' ' ' PHE . 18.4 t -58.24 -22.15 19.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 72.24 111.16 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.1 m -77.61 -2.55 36.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.476 . . . . 71.52 110.814 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.443 ' O ' HG13 ' A' ' 55' ' ' VAL . 10.8 m-85 -125.82 22.93 7.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.485 . . . . 73.35 110.91 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.51 HG22 ' O ' ' A' ' 51' ' ' PRO . 1.7 m -156.27 154.75 6.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.121 -0.491 . . . . 60.13 111.121 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.632 ' HB2' HD11 ' A' ' 7' ' ' LEU . 37.6 ttm-85 -121.41 128.44 52.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 74.54 110.873 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.631 HD11 ' CE2' ' A' ' 37' ' ' PHE . 42.5 mm -76.72 110.02 11.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.183 -0.462 . . . . 52.32 111.136 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.404 HG23 ' HG2' ' A' ' 56' ' ' ARG . 7.0 pt -126.13 -177.78 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.479 . . . . 54.44 111.082 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -126.09 124.48 40.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.162 -0.472 . . . . 45.4 110.895 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.599 HD23 ' HB2' ' A' ' 3' ' ' PHE . 0.4 OUTLIER -55.02 -26.39 36.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 74.22 110.913 -179.94 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.6 mpp? -90.17 -25.57 20.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 64.5 110.917 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -147.83 75.0 11.11 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.601 0.715 . . . . 63.41 110.872 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.724 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.8 Cg_endo -69.79 -8.39 23.49 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.676 2.251 . . . . 73.43 112.331 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -100.14 -12.92 19.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 52.01 111.132 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.5 ttmm -80.02 -52.1 8.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 52.34 110.908 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.435 ' O ' HG12 ' A' ' 69' ' ' VAL . 78.9 m-85 -95.45 23.11 6.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.446 . . . . 75.43 110.931 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.724 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -90.06 9.91 26.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 74.23 111.101 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 64.4 p -116.62 -24.13 7.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.221 -0.445 . . . . 74.45 110.796 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.527 HG21 ' CD1' ' A' ' 80' ' ' ILE . 13.9 p -56.65 135.28 20.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.17 -0.468 . . . . 71.33 111.12 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -90.33 100.67 13.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 74.14 110.848 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.698 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -57.78 -30.47 65.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 71.15 111.115 -179.851 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -62.72 -44.64 95.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.228 -0.442 . . . . 73.32 110.916 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.6 t0 -63.72 106.56 1.0 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.491 . . . . 72.52 110.869 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.44 -27.94 27.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 72.43 110.851 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -66.52 -54.46 23.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 74.02 110.884 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.455 ' O ' HD12 ' A' ' 80' ' ' ILE . 28.2 mt-30 -59.75 -57.62 12.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.146 -0.479 . . . . 73.45 110.912 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 4.3 p -51.89 -32.76 15.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 72.51 111.12 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 16.5 mtm -67.87 -50.82 54.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 54.24 110.902 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.4 mttt -56.28 -43.86 79.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.254 -0.43 . . . . 52.41 110.854 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.591 HG21 HG21 ' A' ' 57' ' ' ILE . 1.6 mp -63.97 -54.82 26.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 74.11 111.131 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.651 HG23 ' HB ' ' A' ' 86' ' ' ILE . 87.2 mt -57.68 -37.02 56.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.222 -0.445 . . . . 72.53 111.129 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -71.07 -51.71 23.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.21 -0.45 . . . . 64.24 110.834 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -59.47 -50.26 74.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 74.5 110.898 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -67.88 -13.42 62.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 71.1 110.906 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 63.1 mmtt 61.11 48.36 6.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.097 -0.501 . . . . 73.43 110.906 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.651 ' HB ' HG23 ' A' ' 81' ' ' ILE . 24.6 mt -81.66 122.43 80.48 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.651 0.739 . . . . 71.11 111.118 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.8 159.49 53.2 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.703 2.269 . . . . 72.53 112.32 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.407 HG22 ' O ' ' A' ' 31' ' ' HIS . 0.1 OUTLIER -81.38 174.81 11.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.216 -0.447 . . . . 73.42 111.1 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.817 HG12 ' HE2' ' A' ' 93' ' ' LYS . 24.1 t -53.81 -58.53 3.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.459 . . . . 62.22 111.136 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -50.75 -47.68 59.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 72.33 110.874 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -56.12 -39.24 71.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.458 . . . . 73.55 110.912 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -62.03 -48.43 80.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 73.44 110.89 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.817 ' HE2' HG12 ' A' ' 89' ' ' VAL . 17.7 mtmt -58.09 -50.79 72.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.217 -0.447 . . . . 73.23 110.897 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -58.35 -51.68 68.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.258 -0.428 . . . . 53.14 110.865 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -50.63 -52.56 38.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 75.4 110.897 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 74.33 111.118 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 . . . . . 0 C--O 1.232 0.15 0 CA-C-O 120.87 0.367 . . . . 72.05 110.866 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' -6' ' ' ILE . . . . . 0.73 HG23 ' OH ' ' A' ' 32' ' ' TYR . 3.5 mp 47.95 84.73 0.19 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.618 0.723 . . . . 74.41 111.103 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 85.53 0.61 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.688 2.259 . . . . 72.44 112.361 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 1.3 t -74.28 -8.47 56.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.216 -0.447 . . . . 61.31 110.888 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.08 160.39 6.37 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.609 0.719 . . . . 71.21 110.872 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 154.65 67.72 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.688 2.258 . . . . 74.33 112.333 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -107.92 87.42 3.73 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.565 0.698 . . . . 70.13 111.108 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 149.0 66.57 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.721 2.281 . . . . 74.32 112.374 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.0 159.91 64.5 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.58 0.705 . . . . 74.44 110.86 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 167.11 25.46 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.626 2.217 . . . . 54.41 112.351 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 C--O 1.231 0.151 0 C-N-CA 122.69 2.26 . . . . 64.24 112.335 179.993 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.232 0.139 0 CA-C-O 120.825 0.345 . . . . 62.43 110.96 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.474 ' CE1' HD12 ' A' ' 60' ' ' LEU . 14.0 m-85 -128.23 163.14 25.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.209 -0.45 . . . . 71.25 110.913 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.428 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -134.6 170.05 16.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 73.52 111.122 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 24' ' ' GLU . 8.4 p -133.14 131.27 58.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 74.32 111.092 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.723 HG21 ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -75.05 134.53 41.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 71.04 111.171 179.98 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.66 HD11 ' HB2' ' A' ' 56' ' ' ARG . 15.6 mt -109.22 -13.05 14.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 62.13 110.919 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -137.31 156.23 48.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 70.14 110.896 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -83.55 104.98 14.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.11 -0.495 . . . . 54.2 110.886 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -108.72 102.43 11.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.178 -0.465 . . . . 74.21 110.848 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp -78.96 124.34 28.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.114 -0.494 . . . . 73.45 110.928 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.588 ' HB1' ' HB2' ' A' ' 17' ' ' GLU . . . -65.41 145.4 56.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 72.24 111.105 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -96.65 -31.62 12.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 55.4 110.899 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -140.21 179.17 6.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.136 -0.484 . . . . 75.24 110.907 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -59.87 -29.78 68.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.216 -0.447 . . . . 75.04 110.906 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -65.15 -24.56 67.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 64.5 110.868 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.588 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 44.4 mm-40 -104.79 147.92 27.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.459 . . . . 71.43 110.896 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.2 tp -118.12 119.18 33.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.165 -0.47 . . . . 74.41 110.965 179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -57.31 141.34 47.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 63.54 110.865 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.723 ' HB ' HG21 ' A' ' 6' ' ' THR . 0.8 OUTLIER -145.4 158.69 13.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 73.24 111.124 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.5 m -129.09 160.32 64.33 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.656 0.741 . . . . 73.11 110.877 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 119.46 6.41 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.687 2.258 . . . . 72.24 112.374 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.49 -0.46 30.86 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.741 -0.742 . . . . 51.41 112.468 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.559 ' O ' HG23 ' A' ' 5' ' ' VAL . 4.7 mp0 -88.24 166.0 14.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.82 0.343 . . . . 70.21 110.888 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.468 ' CB ' HD12 ' A' ' 42' ' ' ILE . 4.4 m120 -117.38 127.03 53.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 64.43 110.917 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.589 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 2.2 mp -127.41 158.99 35.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 74.34 110.917 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.0 t -111.13 114.87 28.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 74.2 110.878 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.428 HD11 ' HB2' ' A' ' 4' ' ' ALA . 57.2 mt -79.69 144.61 10.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 75.13 111.143 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 29.3 m -118.36 -41.65 2.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 74.34 110.899 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.411 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -155.67 174.63 15.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 74.42 111.093 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.471 ' ND1' HD13 ' A' ' 81' ' ' ILE . 1.3 p80 -126.89 177.73 6.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 70.21 110.868 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.2 t80 -139.91 99.56 3.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 75.32 110.941 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 55.11 25.16 6.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 64.02 110.843 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.59 ' HD2' HD12 ' A' ' 81' ' ' ILE . 34.2 m-85 63.48 16.3 9.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.225 -0.443 . . . . 74.11 110.935 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.465 ' O ' HG23 ' A' ' 52' ' ' VAL . 12.2 mm-40 -103.62 -50.32 3.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 73.51 110.935 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.427 ' CZ2' ' HB2' ' B' ' -3' ' ' ARG . 78.5 m95 -113.06 153.78 27.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.09 -0.505 . . . . 75.54 110.923 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.634 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.4 OUTLIER -126.38 142.64 51.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.25 -0.432 . . . . 71.32 110.933 -179.998 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 21.7 mm -99.16 95.64 4.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.154 -0.475 . . . . 74.24 111.109 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.589 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -108.1 152.86 23.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.461 . . . . 73.14 111.13 179.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.2 mtpt -125.1 159.49 59.03 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.589 0.709 . . . . 74.42 110.905 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.7 139.74 41.17 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.67 2.247 . . . . 74.55 112.381 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.468 HD12 ' CB ' ' A' ' 25' ' ' ASN . 44.2 mt . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.447 . . . . 75.31 111.177 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo . . . . . 0 C--O 1.231 0.126 0 CA-C-O 120.827 0.261 . . . . 64.54 112.357 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -116.91 -111.8 2.65 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.751 -0.738 . . . . 71.35 112.518 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -172.12 124.61 0.52 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.843 0.354 . . . . 65.24 110.949 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.42 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.1 p -139.46 132.98 15.65 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.58 0.705 . . . . 64.23 111.146 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.579 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.1 Cg_endo -69.75 160.58 49.19 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.66 2.24 . . . . 73.23 112.325 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.764 HG12 ' HB ' ' A' ' 71' ' ' THR . 8.4 t -72.11 -20.97 20.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 64.02 111.114 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.0 m -79.15 -0.17 30.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 72.44 110.832 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -127.49 17.36 7.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 71.41 110.947 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.579 HG22 ' O ' ' A' ' 51' ' ' PRO . 16.8 m -151.87 161.15 3.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.086 -0.507 . . . . 53.43 111.115 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.66 ' HB2' HD11 ' A' ' 7' ' ' LEU . 39.0 ttm-85 -128.99 131.75 47.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.166 -0.47 . . . . 61.32 110.845 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.404 HG21 HG21 ' A' ' 80' ' ' ILE . 31.1 mm -80.59 108.85 14.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 75.43 111.124 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.445 HG23 ' HG2' ' A' ' 56' ' ' ARG . 4.6 pt -126.81 140.19 49.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 64.54 111.078 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -76.36 128.57 35.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.136 -0.483 . . . . 71.05 110.872 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.474 HD12 ' CE1' ' A' ' 3' ' ' PHE . 0.6 OUTLIER -60.42 -34.97 74.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.181 -0.463 . . . . 73.34 110.872 -179.943 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.1 mmt -83.78 -1.6 54.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 73.04 110.894 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -178.91 82.93 0.21 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.665 0.745 . . . . 62.02 110.884 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.724 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.3 Cg_endo -69.81 -7.93 22.31 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.704 2.27 . . . . 71.31 112.284 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.46 -8.49 44.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 73.12 111.146 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -81.97 -47.09 13.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 62.21 110.883 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.641 ' O ' HG12 ' A' ' 69' ' ' VAL . 14.2 m-85 -103.72 23.47 12.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 73.31 110.916 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.724 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -84.23 -16.87 41.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 54.01 111.09 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 39.8 p -94.18 -23.76 17.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 71.34 110.829 -179.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.988 HG21 HD11 ' A' ' 80' ' ' ILE . 9.8 p -51.33 155.95 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.083 -0.508 . . . . 73.23 111.168 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -113.31 106.77 15.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 75.42 110.857 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.764 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.1 OUTLIER -70.5 -20.81 62.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.445 . . . . 75.03 111.14 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -62.77 -54.91 31.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.231 -0.441 . . . . 74.11 110.91 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -63.89 116.73 6.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 73.54 110.893 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.48 -22.14 41.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 75.15 110.896 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -66.84 -56.01 12.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.175 -0.466 . . . . 74.34 110.928 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -58.71 -57.12 14.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 62.24 110.924 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.513 ' HA ' HD12 ' A' ' 80' ' ' ILE . 3.2 p -52.72 -31.91 16.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 73.2 111.13 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.8 mtm -67.57 -55.12 14.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 61.23 110.865 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 50.8 mttt -55.36 -38.64 69.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 75.24 110.944 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.988 HD11 HG21 ' A' ' 69' ' ' VAL . 15.4 mt -65.3 -53.08 44.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.226 -0.443 . . . . 73.53 111.105 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.721 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.1 mt -61.95 -35.9 70.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 73.02 111.145 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -71.02 -44.77 65.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 72.41 110.905 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -67.89 -47.84 67.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 71.2 110.891 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -69.21 -11.5 60.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 74.5 110.86 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 45.9 mmtt 58.32 53.89 6.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.461 . . . . 72.45 110.887 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.721 ' HB ' HG23 ' A' ' 81' ' ' ILE . 23.7 mt -88.14 124.33 66.88 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 75.24 111.134 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.411 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 53.3 Cg_endo -69.76 164.15 35.63 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.642 2.228 . . . . 54.44 112.33 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.97 167.33 13.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 65.41 111.128 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.473 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 97.7 t -50.61 -58.41 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 74.13 111.122 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -46.05 -53.16 10.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 72.13 110.906 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 74.9 mm-40 -56.38 -34.16 66.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 63.01 110.913 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . 0.453 ' O ' HG23 ' A' ' 96' ' ' THR . 26.8 t90 -71.25 -36.2 71.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.199 -0.455 . . . . 74.53 110.878 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' A' ' 89' ' ' VAL . 1.6 mmmt -68.62 -37.56 79.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.451 . . . . 71.23 110.917 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -71.38 -50.83 28.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.227 -0.442 . . . . 74.23 110.888 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . 0.412 ' HG2' ' HA ' ' A' ' 92' ' ' TRP . 5.1 pt20 -58.8 -38.83 79.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.194 -0.457 . . . . 73.13 110.867 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . 0.453 HG23 ' O ' ' A' ' 92' ' ' TRP . 26.2 p . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.251 -0.431 . . . . 62.34 111.093 -179.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 . . . . . 0 C--O 1.231 0.096 0 CA-C-O 120.848 0.356 . . . . 73.45 110.91 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.8 mm 51.41 74.37 0.81 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.651 0.739 . . . . 42.03 111.119 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 101.26 0.9 Allowed 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.703 2.268 . . . . 75.04 112.326 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 24.2 t -89.33 1.47 55.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 71.1 110.841 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' -3' ' ' ARG . . . . . 0.427 ' HB2' ' CZ2' ' A' ' 36' ' ' TRP . 19.7 mmt-85 -50.75 160.38 0.79 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.589 0.709 . . . . 74.34 110.915 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 -22.88 31.62 Favored 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.725 2.283 . . . . 45.42 112.354 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.6 85.03 0.17 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.585 0.707 . . . . 74.33 111.122 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 159.45 53.41 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.742 2.295 . . . . 73.14 112.303 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 11.4 mtpt -94.7 160.08 32.12 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.565 0.698 . . . . 74.13 110.9 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 166.66 26.76 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.668 2.245 . . . . 63.33 112.369 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo . . . . . 0 C--O 1.231 0.145 0 C-N-CA 122.7 2.267 . . . . 71.41 112.332 179.936 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.3 pt? . . . . . 0 C--O 1.232 0.134 0 CA-C-O 120.814 0.34 . . . . 74.32 110.932 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -112.06 145.15 40.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.258 -0.428 . . . . 65.32 110.893 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.608 ' HB1' HG13 ' A' ' 55' ' ' VAL . . . -126.66 153.57 45.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 73.31 111.118 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 24' ' ' GLU . 6.6 p -121.66 122.5 67.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.24 -0.436 . . . . 60.11 111.129 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -59.18 140.17 56.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 64.31 111.126 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.586 HD21 ' HB2' ' A' ' 56' ' ' ARG . 3.5 mt -106.04 -16.42 14.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 70.44 110.907 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -139.25 164.31 30.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 61.24 110.911 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -87.19 104.8 16.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 72.01 110.895 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -106.74 109.37 21.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 73.23 110.86 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -83.84 142.24 30.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.105 -0.498 . . . . 75.44 110.947 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.62 136.1 50.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.425 . . . . 60.21 111.093 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -105.53 -26.61 11.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.449 . . . . 72.41 110.884 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -127.1 -178.59 4.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.49 . . . . 63.43 110.886 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -67.43 -25.97 66.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 64.13 110.879 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.74 -45.6 15.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 73.01 110.823 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -55.88 158.27 3.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 70.52 110.939 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.4 tp -133.73 145.81 50.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 65.24 110.918 -179.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -82.65 130.74 35.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 74.13 110.881 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.989 HG11 HD21 ' A' ' 26' ' ' LEU . 0.2 OUTLIER -139.96 158.93 26.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 75.34 111.149 179.984 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -125.18 159.09 61.15 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.692 0.758 . . . . 55.3 110.873 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 117.78 5.29 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.698 2.265 . . . . 72.53 112.312 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.25 7.12 35.61 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.756 -0.735 . . . . 53.11 112.495 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.468 ' O ' HG23 ' A' ' 5' ' ' VAL . 24.4 mm-40 -92.2 153.69 19.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.898 0.38 . . . . 44.12 110.872 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.644 ' HB3' HD12 ' A' ' 42' ' ' ILE . 7.0 m120 -94.8 123.11 38.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.158 -0.474 . . . . 75.44 110.855 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.989 HD21 HG11 ' A' ' 20' ' ' VAL . 7.9 mp -124.1 149.32 46.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.208 -0.451 . . . . 71.32 110.907 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.79 123.89 46.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.457 . . . . 63.41 110.889 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 31.7 mm -74.74 144.84 11.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.132 -0.485 . . . . 72.41 111.087 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 55.8 m -124.6 -35.2 2.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.134 -0.485 . . . . 64.53 110.888 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -176.03 171.9 2.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 30.25 111.088 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.474 ' CE1' HG21 ' A' ' 81' ' ' ILE . 1.7 p80 -124.95 173.35 8.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 55.44 110.86 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -135.39 99.55 4.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.241 -0.436 . . . . 63.22 110.906 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.8 t0 53.88 26.46 6.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.116 -0.493 . . . . 54.44 110.878 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.53 ' HD2' HD12 ' A' ' 81' ' ' ILE . 43.7 m-85 62.77 27.77 16.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 64.1 110.938 -179.81 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -116.69 -48.24 2.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 65.32 110.9 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 70.1 m95 -114.09 145.86 41.04 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.153 -0.476 . . . . 73.24 110.942 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.575 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -121.08 139.46 53.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.258 -0.428 . . . . 72.51 110.9 -179.931 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.6 mm -95.02 95.21 4.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.191 -0.459 . . . . 72.04 111.124 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.811 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -107.55 145.06 33.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 73.42 111.102 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -123.53 156.59 64.09 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.567 0.698 . . . . 75.23 110.89 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 125.71 12.45 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.672 2.248 . . . . 63.21 112.367 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.644 HD12 ' HB3' ' A' ' 25' ' ' ASN . 58.4 mt . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 71.45 111.131 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo . . . . . 0 C--O 1.23 0.117 0 CA-C-O 120.798 0.249 . . . . 64.25 112.351 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -116.72 -122.19 3.33 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.787 -0.721 . . . . 65.01 112.5 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -160.18 125.3 3.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.846 0.355 . . . . 71.24 110.882 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.426 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.2 p -139.98 133.29 15.23 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.609 0.719 . . . . 51.14 111.134 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.426 ' HD2' HG23 ' A' ' 50' ' ' VAL . 54.4 Cg_endo -69.75 150.32 68.14 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.683 2.255 . . . . 75.23 112.378 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.726 HG12 ' HB ' ' A' ' 71' ' ' THR . 21.6 t -58.0 -22.06 18.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 72.42 111.142 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.9 m -77.97 -2.08 35.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 50.22 110.822 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -126.1 10.19 7.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 72.14 110.912 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.608 HG13 ' HB1' ' A' ' 4' ' ' ALA . 2.4 t -147.21 139.73 19.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.494 . . . . 71.32 111.107 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.586 ' HB2' HD21 ' A' ' 7' ' ' LEU . 31.9 ttm180 -104.97 131.21 52.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 71.14 110.904 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.496 HG21 HG21 ' A' ' 80' ' ' ILE . 30.0 mm -87.16 108.94 18.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 73.21 111.126 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.554 HG23 ' HG2' ' A' ' 56' ' ' ARG . 3.1 pt -123.01 160.47 25.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 74.12 111.101 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 60.8 t0 -97.38 125.38 41.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 74.13 110.844 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mt -51.65 -37.55 50.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.476 . . . . 52.34 110.928 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.79 -31.27 35.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.141 -0.481 . . . . 71.11 110.912 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . 0.42 ' HB2' ' HB2' ' A' ' 65' ' ' LYS . 0.1 OUTLIER -137.69 78.32 37.22 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.606 0.717 . . . . 72.21 110.898 179.969 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.766 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.7 Cg_endo -69.8 -8.12 22.8 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.641 2.227 . . . . 61.15 112.354 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.84 -33.68 11.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 35.4 111.123 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 62' ' ' ASP . 0.0 OUTLIER -65.14 -51.8 59.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 50.12 110.87 179.989 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.525 ' HA ' HG23 ' A' ' 69' ' ' VAL . 20.3 m-85 -90.78 18.95 5.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.436 . . . . 75.04 110.933 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.766 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -84.14 -23.06 30.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.122 -0.49 . . . . 73.22 111.11 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 47.3 t -94.6 -5.68 45.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 71.1 110.844 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.525 HG23 ' HA ' ' A' ' 66' ' ' TYR . 53.6 t -51.26 121.78 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.117 -0.492 . . . . 75.21 111.147 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -77.53 75.72 4.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.189 -0.46 . . . . 62.3 110.864 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.726 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -47.43 -34.16 6.91 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.446 . . . . 62.22 111.136 -179.853 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -58.71 -44.47 90.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.218 -0.446 . . . . 72.43 110.898 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -69.09 113.98 6.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.104 -0.498 . . . . 73.13 110.866 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.22 -23.77 37.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 74.35 110.884 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -65.78 -54.98 19.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 74.03 110.872 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . 0.715 ' O ' HD12 ' A' ' 80' ' ' ILE . 4.5 mm-40 -58.67 -58.23 9.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 73.32 110.875 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -51.61 -31.68 12.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.274 -0.421 . . . . 73.45 111.171 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 9.2 mtm -68.71 -51.11 45.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.104 -0.498 . . . . 61.12 110.846 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -56.95 -43.36 81.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.447 . . . . 74.42 110.86 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.715 HD12 ' O ' ' A' ' 76' ' ' GLN . 1.8 mp -64.43 -53.35 43.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 73.21 111.15 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.53 HD12 ' HD2' ' A' ' 34' ' ' TYR . 88.5 mt -59.64 -36.65 66.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 72.44 111.113 179.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -71.17 -52.25 20.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 63.43 110.891 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -60.77 -50.84 71.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 65.11 110.894 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -67.82 -15.07 63.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 75.21 110.9 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp 57.88 51.82 8.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 71.5 110.923 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.449 HD12 HG12 ' A' ' 81' ' ' ILE . 27.8 mt -77.94 131.5 69.91 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.658 0.742 . . . . 71.35 111.123 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 152.0 69.29 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.661 2.24 . . . . 73.43 112.352 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.73 170.24 15.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 75.0 111.188 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 31' ' ' HIS . 95.2 t -52.01 -55.2 10.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.253 -0.43 . . . . 70.31 111.166 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -51.95 -46.42 64.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.142 -0.481 . . . . 70.34 110.868 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 58.7 mm-40 -59.68 -42.7 93.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 73.33 110.936 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 25.3 t90 -64.94 -38.26 90.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 74.44 110.925 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.86 -49.54 70.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 74.43 110.923 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -61.65 -45.44 94.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.45 . . . . 73.23 110.843 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -58.78 -51.67 68.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 74.12 110.881 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 5.5 p . . . . . 0 C--N 1.33 -0.25 0 CA-C-N 116.156 -0.474 . . . . 73.34 111.182 -179.931 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 . . . . . 0 C--O 1.231 0.106 0 CA-C-O 120.8 0.333 . . . . 74.55 110.902 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 22.3 mm 50.51 80.3 0.3 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.661 0.743 . . . . 73.31 111.138 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 113.49 3.39 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.668 2.245 . . . . 62.33 112.351 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -123.92 56.6 1.23 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 42.32 110.82 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' -3' ' ' ARG . . . . . 0.4 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 0.1 OUTLIER -109.94 163.59 16.77 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.591 0.71 . . . . 72.2 110.873 -179.928 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' -2' ' ' PRO . . . . . 0.4 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.4 Cg_endo -69.84 -6.46 18.69 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.655 2.237 . . . . 54.33 112.359 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 51.47 88.13 0.12 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.554 0.692 . . . . 74.52 111.105 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.76 126.6 13.5 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.678 2.252 . . . . 42.25 112.371 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 19.2 mtmm -66.34 160.1 67.94 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.532 0.682 . . . . 75.32 110.931 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 167.32 24.76 Favored 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.719 2.279 . . . . 75.53 112.372 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo . . . . . 0 N--CA 1.466 -0.141 0 C-N-CA 122.719 2.279 . . . . 70.34 112.322 179.963 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.9 pp . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.819 0.342 . . . . 72.1 110.942 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -117.45 163.61 16.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 73.31 110.881 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.429 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -134.93 164.13 28.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 64.55 111.118 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 24' ' ' GLU . 7.6 p -131.6 131.09 62.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 74.02 111.148 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.713 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -72.87 136.56 45.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.194 -0.457 . . . . 73.14 111.137 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.669 HD11 ' HB2' ' A' ' 56' ' ' ARG . 17.4 mt -108.37 -16.07 14.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 73.44 110.917 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -135.35 161.85 34.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.451 . . . . 53.31 110.909 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -84.35 105.02 14.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.085 -0.507 . . . . 73.31 110.895 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -89.61 100.24 13.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 54.54 110.912 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -80.23 106.85 12.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 74.13 110.868 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.526 ' HB1' ' HB2' ' A' ' 17' ' ' GLU . . . -58.23 152.83 16.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 73.51 111.098 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -113.73 -30.97 6.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.242 -0.435 . . . . 73.34 110.92 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.5 mmp_? -121.21 -179.85 4.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.136 -0.484 . . . . 63.13 110.906 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -64.12 -39.1 93.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.456 . . . . 62.0 110.844 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -63.11 -50.82 69.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.443 . . . . 71.33 110.865 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.526 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 55.5 mm-40 -55.07 135.65 48.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 72.35 110.894 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.7 tp -108.37 136.93 47.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 64.12 110.907 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -85.18 128.68 34.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 64.23 110.859 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.713 ' CG1' HG21 ' A' ' 6' ' ' THR . 7.1 p -140.19 143.3 29.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 64.44 111.127 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -101.81 160.36 26.7 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.688 0.756 . . . . 33.41 110.836 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 121.79 8.48 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.711 2.274 . . . . 75.35 112.319 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.12 5.69 30.36 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.701 -0.761 . . . . 72.14 112.479 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . 0.623 ' O ' HG23 ' A' ' 5' ' ' VAL . 29.5 mt-10 -92.2 169.2 10.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.883 0.373 . . . . 72.41 110.884 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -113.51 123.33 49.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 74.14 110.836 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.694 HD11 HG21 ' A' ' 20' ' ' VAL . 4.4 mp -123.18 150.12 43.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.109 -0.496 . . . . 71.23 110.929 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.94 112.92 26.17 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.175 -0.466 . . . . 63.43 110.832 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.429 HD11 ' HB2' ' A' ' 4' ' ' ALA . 59.6 mt -76.77 145.36 10.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 74.2 111.17 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.7 m -119.51 -32.6 4.29 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.137 -0.483 . . . . 75.41 110.874 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.418 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -170.04 174.09 5.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 42.22 111.08 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.416 ' CG ' HD13 ' A' ' 81' ' ' ILE . 2.7 p80 -123.77 178.02 5.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 64.33 110.844 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -150.66 104.67 3.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 65.42 110.912 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 59.93 17.75 6.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.111 -0.495 . . . . 72.34 110.859 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.61 ' HD2' HD12 ' A' ' 81' ' ' ILE . 24.1 m-85 60.97 20.82 11.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 73.22 110.902 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -117.68 -24.42 7.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 71.43 110.912 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.408 ' HB3' HD21 ' A' ' 49' ' ' LEU . 81.3 m95 -132.23 135.81 46.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.107 -0.497 . . . . 75.13 110.902 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.615 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -118.08 131.99 56.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.202 -0.453 . . . . 74.21 110.877 -179.937 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.4 mm -89.13 94.74 4.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 53.41 111.142 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.408 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -115.54 152.34 33.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.457 . . . . 60.05 111.085 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.0 ptpp? -122.44 157.05 60.05 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.563 0.696 . . . . 72.32 110.908 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 136.7 33.76 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.683 2.255 . . . . 75.1 112.372 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 69.1 mt . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 64.5 111.155 179.923 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.466 -0.13 0 CA-C-O 120.837 0.266 . . . . 73.44 112.321 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -129.63 -138.29 4.39 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.753 -0.737 . . . . 52.44 112.472 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.417 HD12 ' HB3' ' B' ' -7' ' ' PHE . 0.7 OUTLIER -148.46 126.88 12.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.86 0.362 . . . . 72.14 110.885 -179.901 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.419 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.5 p -136.8 133.45 18.85 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.597 0.713 . . . . 73.14 111.126 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.419 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.6 Cg_endo -69.77 158.4 57.06 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.665 2.244 . . . . 73.4 112.349 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.781 HG12 ' HB ' ' A' ' 71' ' ' THR . 6.9 t -70.09 -20.57 23.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 70.31 111.138 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.9 m -81.24 3.82 22.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 62.22 110.853 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . 0.499 ' O ' HG22 ' A' ' 6' ' ' THR . 17.0 m-85 -131.94 22.1 4.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.474 . . . . 65.32 110.918 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.412 HG22 ' O ' ' A' ' 51' ' ' PRO . 18.8 m -152.14 160.34 3.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 74.22 111.163 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.669 ' HB2' HD11 ' A' ' 7' ' ' LEU . 21.4 ttp180 -127.62 120.56 28.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.228 -0.442 . . . . 73.05 110.89 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.6 mm -71.9 123.03 25.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 62.34 111.083 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.433 HG23 ' HG2' ' A' ' 56' ' ' ARG . 16.0 pt -141.86 172.07 10.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 71.42 111.143 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 48.8 t0 -119.42 129.74 54.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.466 . . . . 74.42 110.883 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 60' ' ' LEU . 16.6 mt -53.57 -27.73 27.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 72.03 110.908 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.2 mmt -88.01 -31.69 19.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 74.23 110.864 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -139.44 73.7 35.73 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.596 0.712 . . . . 73.12 110.863 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.531 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.8 Cg_endo -69.73 -8.58 23.97 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.731 2.288 . . . . 51.12 112.331 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -103.33 -12.8 17.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 72.32 111.091 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -75.23 -51.77 12.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.45 . . . . 71.12 110.906 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.623 ' O ' HG12 ' A' ' 69' ' ' VAL . 61.6 m-85 -96.77 23.13 7.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 73.43 110.943 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -85.83 -18.64 32.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 74.32 111.135 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 35.6 t -94.21 -23.42 17.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 62.4 110.904 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.994 HG21 HD11 ' A' ' 80' ' ' ILE . 7.4 p -51.29 154.83 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.119 -0.492 . . . . 74.22 111.118 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -107.89 110.24 21.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 61.32 110.853 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.781 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -71.65 -38.88 70.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 75.5 111.145 -179.913 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -55.11 -42.16 72.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.197 -0.456 . . . . 75.03 110.925 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 52.9 t0 -63.9 105.66 0.88 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 74.14 110.924 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.01 -29.24 20.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 72.43 110.845 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -66.98 -56.17 11.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 62.42 110.862 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -59.1 -55.07 39.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 71.04 110.905 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.463 ' HA ' HD12 ' A' ' 80' ' ' ILE . 5.4 p -54.24 -32.7 24.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 64.25 111.138 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.3 mtm -67.3 -55.68 12.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 45.45 110.9 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.8 mttm -55.02 -38.25 67.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.438 . . . . 65.12 110.883 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.994 HD11 HG21 ' A' ' 69' ' ' VAL . 34.4 mt -65.46 -54.88 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 72.13 111.132 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.73 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.8 mt -61.0 -36.1 69.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.139 -0.482 . . . . 64.04 111.149 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -71.03 -47.68 57.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 73.34 110.861 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -63.03 -52.36 63.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.162 -0.472 . . . . 64.13 110.88 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -67.87 -15.8 63.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 71.41 110.866 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.6 mmtm 60.95 62.07 1.51 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.484 . . . . 74.42 110.944 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.73 ' HB ' HG23 ' A' ' 81' ' ' ILE . 54.7 mt -92.05 132.42 32.6 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.615 0.722 . . . . 52.14 111.144 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.418 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 53.6 Cg_endo -69.81 169.93 17.84 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.707 2.272 . . . . 73.42 112.314 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -106.07 177.73 4.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 64.43 111.115 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.5 t -59.82 -52.79 56.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.204 -0.453 . . . . 71.02 111.118 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -54.15 -52.65 60.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 60.44 110.874 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -60.64 -38.78 85.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.156 -0.475 . . . . 73.32 110.937 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 31.2 t90 -66.45 -37.91 86.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.21 -0.45 . . . . 71.53 110.879 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.3 mmpt? -66.95 -49.38 65.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.273 -0.422 . . . . 73.14 110.899 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -61.74 -43.57 98.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 74.5 110.882 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -61.0 -52.91 63.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 73.43 110.89 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.9 p . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 75.31 111.166 -179.937 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' -7' ' ' PHE . . . . . 0.417 ' HB3' HD12 ' A' ' 49' ' ' LEU . 38.2 m-85 . . . . . 0 C--O 1.232 0.135 0 CA-C-O 120.866 0.365 . . . . 75.34 110.895 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.6 mm 54.65 77.88 0.42 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.588 0.709 . . . . 71.31 111.155 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 87.49 0.56 Allowed 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.688 2.258 . . . . 72.33 112.294 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 33.5 t -104.01 34.17 3.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 55.43 110.859 -179.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' -3' ' ' ARG . . . . . 0.43 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 2.5 mtp85 -95.83 161.07 28.7 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.64 0.733 . . . . 74.03 110.852 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' -2' ' ' PRO . . . . . 0.43 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.4 Cg_endo -69.73 111.03 2.69 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.671 2.247 . . . . 74.41 112.342 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' -1' ' ' ALA . . . . . 0.411 ' HA ' ' HD2' ' B' ' 0' ' ' PRO . . . -50.09 108.2 0.96 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.595 0.712 . . . . 73.11 111.104 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 0' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' B' ' -1' ' ' ALA . 53.6 Cg_endo -69.81 145.69 57.6 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.73 2.287 . . . . 53.22 112.311 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -97.3 137.49 21.17 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.536 0.684 . . . . 74.11 110.903 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 165.67 30.21 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.647 2.231 . . . . 72.25 112.379 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo . . . . . 0 C--N 1.341 0.164 0 C-N-CA 122.688 2.259 . . . . 74.23 112.327 -179.998 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.79 HD11 HG13 ' A' ' 28' ' ' ILE . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.108 0 CA-C-O 120.827 0.346 . . . . 64.53 110.938 . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.78 ' CD2' HD22 ' A' ' 60' ' ' LEU . 16.6 m-30 -117.37 139.43 50.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 72.43 110.858 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -109.7 170.11 8.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 72.14 111.093 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.95 125.89 58.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 74.31 111.133 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.745 HG21 ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -71.84 135.45 46.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 65.33 111.14 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.466 HD11 ' HB2' ' A' ' 56' ' ' ARG . 40.3 mt -105.56 -16.34 14.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.246 -0.434 . . . . 61.44 110.89 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -138.39 158.3 44.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 74.2 110.912 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -84.27 104.74 14.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.07 -0.514 . . . . 52.14 110.875 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -97.17 123.36 40.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 74.1 110.846 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.73 121.13 40.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 73.1 110.892 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.58 ' HB1' ' HB3' ' A' ' 17' ' ' GLU . . . -63.46 164.9 8.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.223 -0.444 . . . . 71.24 111.09 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -116.44 -29.49 6.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.21 -0.45 . . . . 62.13 110.899 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 -135.89 -176.18 4.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 45.03 110.828 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -63.5 -43.23 97.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 70.31 110.858 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.06 -53.15 59.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.466 . . . . 74.43 110.876 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.58 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 1.9 tp10 -67.42 149.41 50.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.156 -0.474 . . . . 61.12 110.901 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 3.1 tp -121.17 154.16 36.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.484 . . . . 70.41 110.909 -179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -94.34 148.16 22.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.186 -0.461 . . . . 72.22 110.862 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.745 ' HB ' HG21 ' A' ' 6' ' ' THR . 0.1 OUTLIER -144.4 159.22 15.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 64.3 111.133 179.977 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -124.51 157.0 66.79 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.675 0.75 . . . . 71.31 110.861 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 117.68 5.23 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.726 2.284 . . . . 64.22 112.309 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.93 5.2 33.42 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.68 -0.771 . . . . 71.23 112.481 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -91.84 151.67 20.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.819 0.342 . . . . 64.34 110.905 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -100.69 113.36 26.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 72.52 110.878 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.702 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 4.1 mp -112.33 168.22 9.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.15 -0.477 . . . . 74.12 110.949 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.9 t -121.52 116.15 24.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.455 . . . . 43.04 110.843 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.79 HG13 HD11 ' A' ' 2' ' ' LEU . 27.9 mm -68.55 147.63 12.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 63.34 111.101 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 27.7 m -125.43 -37.05 2.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 74.14 110.875 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -170.25 171.76 6.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 52.41 111.123 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . 0.533 ' O ' HG22 ' A' ' 88' ' ' THR . 2.9 p80 -126.44 175.45 7.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.231 -0.44 . . . . 72.23 110.844 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -147.01 102.17 3.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 74.22 110.927 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 60.9 18.18 8.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.495 . . . . 64.21 110.85 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.581 ' CD2' HD12 ' A' ' 81' ' ' ILE . 43.9 m-85 62.1 19.82 11.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.177 -0.465 . . . . 63.53 110.931 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -119.03 -4.24 10.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.081 -0.509 . . . . 75.13 110.833 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.432 ' HB3' HD21 ' A' ' 49' ' ' LEU . 79.3 m95 -150.01 135.7 18.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.139 -0.482 . . . . 74.21 110.878 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.62 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -121.9 144.91 48.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 74.4 110.842 -179.944 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 11.7 mm -103.51 94.88 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.483 . . . . 75.43 111.141 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.702 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.19 139.49 45.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 64.14 111.123 179.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 pttp -115.33 157.11 44.73 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.547 0.689 . . . . 64.45 110.918 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 108.39 2.07 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.664 2.242 . . . . 72.41 112.328 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.416 HD11 ' CG ' ' A' ' 3' ' ' PHE . 62.3 mt . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 70.03 111.156 179.888 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo . . . . . 0 N--CA 1.466 -0.1 0 CA-C-O 120.864 0.277 . . . . 64.15 112.331 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -128.85 -136.93 4.24 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.756 -0.735 . . . . 75.24 112.485 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.507 HD12 ' HB3' ' B' ' -7' ' ' PHE . 1.0 OUTLIER -144.86 126.87 15.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.869 0.366 . . . . 65.12 110.876 -179.94 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.421 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.3 p -140.53 132.8 14.4 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.617 0.722 . . . . 54.11 111.107 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.421 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.8 Cg_endo -69.78 151.04 68.84 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.683 2.255 . . . . 75.2 112.37 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.74 HG12 ' HB ' ' A' ' 71' ' ' THR . 15.9 t -61.97 -21.67 26.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.243 -0.435 . . . . 73.44 111.133 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.9 t -77.56 -4.11 44.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 34.42 110.856 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -122.45 15.21 10.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.123 -0.489 . . . . 72.24 110.92 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.8 m -151.42 156.33 6.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 60.21 111.084 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.466 ' HB2' HD11 ' A' ' 7' ' ' LEU . 21.1 ttm180 -125.52 124.56 41.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 74.23 110.865 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . 0.505 HG21 HG21 ' A' ' 80' ' ' ILE . 40.7 mm -74.72 108.98 6.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 73.01 111.143 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.461 HG23 ' HG2' ' A' ' 56' ' ' ARG . 1.1 pt -126.45 167.93 20.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 73.5 111.176 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -107.89 119.72 40.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.206 -0.452 . . . . 75.24 110.88 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.78 HD22 ' CD2' ' A' ' 3' ' ' PHE . 0.1 OUTLIER -50.78 -30.83 15.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 65.41 110.877 -179.93 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.442 ' HE2' ' HG ' ' A' ' 60' ' ' LEU . 2.8 mtm -81.72 -34.75 30.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 64.34 110.898 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -141.02 76.3 22.46 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.596 0.712 . . . . 75.21 110.818 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.741 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.3 Cg_endo -69.84 -7.84 22.08 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.707 2.271 . . . . 63.14 112.303 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.77 -12.37 25.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 55.34 111.095 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.9 ttmt -84.31 -51.06 7.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.261 -0.427 . . . . 73.15 110.917 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.552 ' O ' HG12 ' A' ' 69' ' ' VAL . 43.9 m-85 -94.98 23.25 5.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.175 -0.466 . . . . 73.13 110.935 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.741 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -86.57 -18.16 32.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.103 -0.498 . . . . 75.44 111.136 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 9.6 p -93.18 -16.07 25.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 71.01 110.882 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.755 HG21 HD11 ' A' ' 80' ' ' ILE . 9.9 p -51.08 144.36 2.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.118 -0.492 . . . . 72.34 111.126 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -103.78 86.5 2.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.166 -0.47 . . . . 75.41 110.844 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.74 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -51.71 -29.95 20.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 75.13 111.142 -179.887 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -59.41 -47.99 83.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 75.32 110.905 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -64.05 112.22 2.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 71.41 110.856 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.66 -26.68 34.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 63.23 110.877 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -66.33 -49.59 66.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 74.11 110.921 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 3.1 mm100 -61.74 -56.07 23.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 74.34 110.931 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.519 ' HA ' HD12 ' A' ' 80' ' ' ILE . 0.5 OUTLIER -55.69 -30.83 27.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 72.41 111.134 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.3 mtm -67.83 -56.89 7.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 72.13 110.876 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 44.4 mttt -57.36 -36.3 71.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 72.54 110.942 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.755 HD11 HG21 ' A' ' 69' ' ' VAL . 24.7 mt -65.72 -51.38 62.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 65.3 111.116 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.752 HG23 ' HB ' ' A' ' 86' ' ' ILE . 95.9 mt -61.03 -34.79 61.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.13 -0.486 . . . . 75.45 111.145 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -71.19 -47.29 58.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.476 . . . . 74.32 110.858 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -66.47 -45.68 78.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.199 -0.455 . . . . 73.22 110.927 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -73.98 -10.33 59.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.142 -0.481 . . . . 73.42 110.839 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.36 44.37 18.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.131 -0.486 . . . . 74.24 110.935 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.752 ' HB ' HG23 ' A' ' 81' ' ' ILE . 16.1 mt -77.25 120.3 81.0 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.597 0.713 . . . . 73.41 111.16 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.83 166.63 27.04 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.685 2.257 . . . . 72.11 112.311 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . 0.533 HG22 ' O ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -90.66 169.96 10.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 74.31 111.149 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.7 t -51.42 -57.73 2.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.207 -0.451 . . . . 74.01 111.138 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -51.35 -44.27 62.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.203 -0.453 . . . . 75.23 110.887 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 71.0 mm-40 -62.19 -46.26 89.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.13 -0.486 . . . . 71.55 110.952 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -61.13 -40.13 92.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 72.24 110.951 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -64.15 -51.68 62.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 72.31 110.929 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -58.84 -39.5 81.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 65.41 110.883 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -62.7 -53.58 52.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 74.13 110.891 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.446 . . . . 74.34 111.166 -179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' -7' ' ' PHE . . . . . 0.507 ' HB3' HD12 ' A' ' 49' ' ' LEU . 39.4 m-85 . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.844 0.354 . . . . 73.43 110.888 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 12.8 mm 49.1 78.35 0.41 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.577 0.703 . . . . 70.14 111.165 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 82.37 0.75 Allowed 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.692 2.261 . . . . 72.41 112.377 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -90.68 47.84 1.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 71.21 110.88 -179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' -3' ' ' ARG . . . . . 0.433 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 0.2 OUTLIER -105.13 163.21 17.62 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.645 0.736 . . . . 72.23 110.851 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' -2' ' ' PRO . . . . . 0.433 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.9 Cg_endo -69.76 -5.98 17.5 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.684 2.256 . . . . 73.54 112.332 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' -1' ' ' ALA . . . . . 0.418 ' HA ' ' HD2' ' B' ' 0' ' ' PRO . . . 51.22 89.4 0.1 OUTLIER Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.543 0.687 . . . . 75.13 111.094 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 0' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' B' ' -1' ' ' ALA . 54.1 Cg_endo -69.74 129.63 17.95 Favored 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.705 2.27 . . . . 41.32 112.36 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -70.6 160.44 81.65 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.585 0.707 . . . . 63.15 110.901 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 166.39 27.79 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.693 2.262 . . . . 74.0 112.353 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 C--N 1.341 0.166 0 C-N-CA 122.65 2.233 . . . . 63.4 112.346 179.965 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.5 pp . . . . . 0 C--O 1.231 0.11 0 CA-C-O 120.854 0.359 . . . . 63.14 110.899 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -122.47 163.11 20.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.208 -0.451 . . . . 62.01 110.884 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . 0.434 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -135.02 163.39 29.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 41.42 111.117 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.475 HG12 HG12 ' A' ' 58' ' ' ILE . 7.5 p -127.43 124.95 64.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 51.1 111.092 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.766 HG21 HG11 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -68.72 145.67 53.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 55.23 111.117 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.632 HD11 ' HB2' ' A' ' 56' ' ' ARG . 15.7 mt -114.46 -13.74 12.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 74.25 110.857 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -138.33 170.22 16.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 73.14 110.931 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -92.68 104.92 17.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 73.2 110.881 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . 0.497 ' HB3' HG12 ' A' ' 20' ' ' VAL . 26.8 t80 -86.9 104.48 16.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 72.31 110.868 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.8 mttp -80.92 101.03 9.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.127 -0.488 . . . . 72.44 110.918 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.15 141.76 17.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 74.11 111.089 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -111.68 -28.76 7.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.203 -0.453 . . . . 71.51 110.85 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 34.0 mmt180 -127.11 -178.11 4.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 63.11 110.854 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -66.95 -37.33 84.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 74.21 110.888 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -67.91 -30.23 69.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 70.3 110.856 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -81.6 135.03 35.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 71.54 110.883 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.9 tp -108.11 150.12 27.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.127 -0.488 . . . . 73.33 110.921 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -91.73 123.26 34.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 62.41 110.868 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.838 HG21 HD11 ' A' ' 26' ' ' LEU . 9.2 p -133.09 156.63 42.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.201 -0.454 . . . . 73.41 111.095 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.93 158.55 40.41 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.709 0.766 . . . . 74.11 110.808 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 118.71 5.85 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.71 2.273 . . . . 64.14 112.341 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.04 -1.41 38.21 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.721 -0.752 . . . . 74.51 112.485 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -83.83 162.24 20.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.828 0.347 . . . . 75.24 110.92 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . 0.418 ' CB ' HD12 ' A' ' 42' ' ' ILE . 6.4 m120 -100.76 132.32 46.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 75.42 110.847 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.838 HD11 HG21 ' A' ' 20' ' ' VAL . 15.2 mt -129.47 151.71 49.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.106 -0.497 . . . . 74.12 110.902 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.69 112.82 25.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 74.32 110.908 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.434 HD11 ' HB2' ' A' ' 4' ' ' ALA . 56.3 mt -80.67 144.44 10.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.141 -0.481 . . . . 75.41 111.139 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.5 m -117.11 -39.96 3.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.193 -0.458 . . . . 45.52 110.856 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.543 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -163.28 173.76 12.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.202 -0.454 . . . . 52.32 111.056 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -119.97 177.96 4.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 73.44 110.819 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.716 ' CE2' HG23 ' B' ' -6' ' ' ILE . 49.8 t80 -148.2 101.17 3.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 71.14 110.912 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 60.15 18.05 7.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 53.45 110.862 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.611 ' HD2' HD12 ' A' ' 81' ' ' ILE . 39.1 m-85 61.61 20.62 11.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.23 -0.441 . . . . 75.02 110.925 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -118.25 -9.33 10.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.11 -0.496 . . . . 51.31 110.879 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.411 ' HB3' HD21 ' A' ' 49' ' ' LEU . 80.6 m95 -149.23 135.81 19.44 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.15 -0.477 . . . . 74.33 110.944 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.642 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -116.45 130.23 56.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.237 -0.438 . . . . 75.15 110.907 -179.964 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.7 mm -83.54 95.1 3.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 61.42 111.136 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.559 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.87 149.61 30.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 42.43 111.114 179.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 pttp -125.04 157.22 67.7 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.555 0.693 . . . . 72.34 110.935 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 135.97 31.7 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.642 2.228 . . . . 74.44 112.335 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.418 HD12 ' CB ' ' A' ' 25' ' ' ASN . 57.2 mt . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 71.13 111.167 179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo . . . . . 0 N--CA 1.466 -0.109 0 CA-C-O 120.863 0.276 . . . . 63.33 112.318 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.5 -141.93 4.55 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.705 -0.76 . . . . 65.21 112.485 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.602 HD11 ' HD3' ' B' ' -5' ' ' PRO . 0.7 OUTLIER -146.24 131.26 18.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.828 0.347 . . . . 44.43 110.939 -179.941 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.435 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.5 p -142.41 133.58 12.93 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.606 0.717 . . . . 72.34 111.196 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.435 ' HD2' HG23 ' A' ' 50' ' ' VAL . 54.0 Cg_endo -69.76 152.69 69.39 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.649 2.233 . . . . 74.11 112.309 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.793 HG12 ' HB ' ' A' ' 71' ' ' THR . 13.1 t -64.85 -21.75 30.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.467 . . . . 70.11 111.145 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.4 t -77.09 -3.07 37.37 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.474 . . . . 74.34 110.863 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -125.09 18.22 8.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 63.44 110.878 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.583 HG22 ' HA ' ' A' ' 52' ' ' VAL . 13.6 m -148.96 159.86 5.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 72.52 111.077 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.632 ' HB2' HD11 ' A' ' 7' ' ' LEU . 18.4 ttm180 -127.28 112.31 14.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 75.44 110.894 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 35.2 mm -64.66 114.14 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.459 . . . . 73.52 111.11 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.509 HG23 ' HG2' ' A' ' 56' ' ' ARG . 1.5 pt -133.52 137.69 52.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 74.14 111.177 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -75.13 122.23 23.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.163 -0.471 . . . . 75.44 110.877 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.4 mt -52.02 -32.79 35.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 73.21 110.93 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 8.5 mmt -83.06 -29.16 29.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.474 . . . . 75.5 110.845 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -145.3 78.95 11.91 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 121.618 0.723 . . . . 75.03 110.905 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.752 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.4 Cg_endo -69.78 -7.73 21.82 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.678 2.252 . . . . 73.11 112.306 -179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.15 -7.89 37.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.258 -0.428 . . . . 63.33 111.123 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.4 mtpt -84.12 -52.11 6.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 63.42 110.9 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.615 ' O ' HG12 ' A' ' 69' ' ' VAL . 12.7 m-85 -97.64 23.73 7.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.204 -0.453 . . . . 74.32 110.941 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.752 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -84.88 -17.06 39.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.088 -0.505 . . . . 33.42 111.053 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 38.0 m -97.87 -18.36 18.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 61.23 110.856 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.896 HG21 HD11 ' A' ' 80' ' ' ILE . 7.3 p -51.2 144.84 2.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.105 -0.498 . . . . 75.11 111.127 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -99.14 87.28 3.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.133 -0.485 . . . . 60.32 110.908 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.793 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -51.92 -34.62 42.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.452 . . . . 73.22 111.203 -179.875 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -58.22 -45.02 88.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 75.13 110.937 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -63.5 109.14 1.54 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.115 -0.493 . . . . 73.52 110.921 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.61 -26.24 31.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 60.11 110.868 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -67.01 -52.85 37.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 73.13 110.895 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -60.99 -56.42 21.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 72.41 110.931 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.576 HG21 HG11 ' A' ' 52' ' ' VAL . 1.5 p -53.7 -31.49 20.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.464 . . . . 73.3 111.135 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 12.3 mtm -68.06 -56.54 8.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.461 . . . . 75.22 110.86 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.1 mttt -55.05 -37.42 66.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.19 -0.459 . . . . 75.42 110.891 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.896 HD11 HG21 ' A' ' 69' ' ' VAL . 48.0 mt -66.32 -52.67 44.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.431 . . . . 73.41 111.157 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.733 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.5 mt -61.96 -35.8 70.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 72.31 111.133 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -69.9 -47.66 61.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.139 -0.482 . . . . 45.22 110.853 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -64.25 -49.25 72.65 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 75.54 110.883 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -68.04 -14.71 63.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 73.33 110.907 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.5 mmtp 60.46 55.81 3.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 72.42 110.941 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.733 ' HB ' HG23 ' A' ' 81' ' ' ILE . 31.4 mt -88.41 126.09 61.45 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.623 0.725 . . . . 70.3 111.159 179.848 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.543 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 54.1 Cg_endo -69.73 163.8 36.9 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.709 2.273 . . . . 64.04 112.361 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.95 172.11 8.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 62.2 111.132 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . 0.413 HG23 ' HB2' ' A' ' 32' ' ' TYR . 88.2 t -51.34 -54.31 12.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.451 . . . . 74.32 111.117 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -50.5 -47.5 57.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 73.35 110.888 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 45.4 mm-40 -62.96 -41.89 99.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.096 -0.502 . . . . 72.12 110.899 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 24.2 t90 -65.19 -39.99 93.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.2 -0.454 . . . . 74.23 110.94 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.82 -49.54 70.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.276 -0.42 . . . . 70.51 110.916 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -63.16 -37.73 88.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 71.13 110.89 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -63.49 -52.04 63.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 73.24 110.915 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.329 -0.284 0 CA-C-N 116.171 -0.468 . . . . 72.34 111.117 -179.917 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 . . . . . 0 C--O 1.231 0.111 0 CA-C-O 120.848 0.356 . . . . 65.52 110.87 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' -6' ' ' ILE . . . . . 0.716 HG23 ' CE2' ' A' ' 32' ' ' TYR . 58.1 mt 45.46 84.47 0.19 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.638 0.732 . . . . 75.32 111.099 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' -5' ' ' PRO . . . . . 0.602 ' HD3' HD11 ' A' ' 49' ' ' LEU . 53.8 Cg_endo -69.79 127.51 14.67 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.666 2.244 . . . . 64.21 112.339 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -114.03 0.73 14.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.239 -0.437 . . . . 75.51 110.874 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -50.63 163.82 0.45 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.635 0.731 . . . . 64.13 110.849 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -16.22 37.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.651 2.234 . . . . 53.1 112.377 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.1 84.65 0.18 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.549 0.69 . . . . 70.33 111.12 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 138.02 36.94 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.679 2.253 . . . . 65.42 112.351 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -71.4 160.69 81.81 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.572 0.701 . . . . 73.31 110.895 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 167.6 24.0 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.635 2.223 . . . . 64.55 112.33 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo . . . . . 0 C--N 1.342 0.192 0 C-N-CA 122.66 2.24 . . . . 65.51 112.382 179.934 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' LEU . . . . . 0.649 HD11 HG13 ' A' ' 28' ' ' ILE . 0.5 OUTLIER . . . . . 0 C--O 1.23 0.075 0 CA-C-O 120.861 0.362 . . . . 75.13 110.907 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.699 ' CG ' HD23 ' A' ' 60' ' ' LEU . 50.1 m-85 -129.8 161.49 30.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 71.01 110.874 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -136.39 161.64 35.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 72.3 111.09 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.463 HG12 HG12 ' A' ' 58' ' ' ILE . 8.7 p -130.76 128.07 62.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.466 . . . . 64.31 111.104 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' THR . . . . . 0.734 HG21 HG11 ' A' ' 20' ' ' VAL . 0.6 OUTLIER -74.32 139.63 44.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.173 -0.467 . . . . 73.2 111.153 179.988 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . 0.792 HD11 ' HB2' ' A' ' 56' ' ' ARG . 9.9 mt -114.9 -15.4 11.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 75.0 110.866 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -135.07 158.2 44.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 74.31 110.918 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -84.38 105.14 14.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.088 -0.506 . . . . 74.4 110.878 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -88.31 117.98 27.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 71.41 110.915 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.7 mttt -93.47 113.18 25.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 71.53 110.845 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . 0.687 ' HB1' ' HB2' ' A' ' 17' ' ' GLU . . . -66.36 156.71 33.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 73.51 111.099 179.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -115.66 -28.55 6.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 73.1 110.867 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.6 mmm180 -133.09 174.55 10.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 74.53 110.856 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -58.85 -40.99 85.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 73.33 110.877 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -60.32 -25.89 66.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.172 -0.467 . . . . 71.31 110.871 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.687 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 5.9 mm-40 -87.62 139.41 30.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.452 . . . . 74.2 110.908 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tp -116.11 123.27 47.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.182 -0.463 . . . . 44.03 110.913 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -74.26 145.73 43.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.184 -0.462 . . . . 71.14 110.874 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.774 HG21 HD11 ' A' ' 26' ' ' LEU . 9.9 p -147.35 156.78 10.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.232 -0.44 . . . . 72.33 111.136 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -113.2 158.45 38.11 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.649 0.738 . . . . 63.45 110.855 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 125.32 12.02 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.681 2.254 . . . . 62.52 112.358 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.16 -6.84 32.49 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.717 -0.754 . . . . 63.43 112.496 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -87.74 143.99 26.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.855 0.36 . . . . 70.34 110.882 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -97.07 120.56 37.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 65.32 110.915 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' LEU . . . . . 0.774 HD11 HG21 ' A' ' 20' ' ' VAL . 2.9 mp -111.89 157.44 20.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 72.22 110.873 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.33 112.85 25.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 74.41 110.836 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . 0.649 HG13 HD11 ' A' ' 2' ' ' LEU . 29.7 mm -69.68 143.5 14.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 73.42 111.097 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.5 m -121.4 -39.7 2.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.15 -0.477 . . . . 74.22 110.925 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.416 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -173.89 173.43 3.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.474 . . . . 72.01 111.105 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -120.87 176.19 5.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 63.41 110.876 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' TYR . . . . . 0.747 ' OH ' HG23 ' B' ' -6' ' ' ILE . 29.7 t80 -146.59 101.01 3.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.198 -0.455 . . . . 72.11 110.941 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ASP . . . . . 0.42 ' HB3' ' CG ' ' A' ' 35' ' ' GLU . 38.0 t0 61.44 16.45 7.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 64.53 110.903 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.613 ' HD2' HD12 ' A' ' 81' ' ' ILE . 40.6 m-85 63.76 30.06 14.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 72.14 110.908 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.42 ' CG ' ' HB3' ' A' ' 33' ' ' ASP . 3.6 pt-20 -132.21 -1.57 3.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.158 -0.474 . . . . 72.44 110.906 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.556 ' HB3' HD21 ' A' ' 49' ' ' LEU . 85.5 m95 -152.75 135.46 15.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.155 -0.475 . . . . 74.42 110.938 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' PHE . . . . . 0.527 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -121.72 139.0 54.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.289 -0.414 . . . . 72.21 110.886 -179.991 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 12.9 mm -93.31 94.79 4.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.126 -0.488 . . . . 72.13 111.131 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ALA . . . . . 0.765 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -108.75 134.87 50.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.466 . . . . 75.22 111.135 179.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.64 156.53 39.52 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.555 0.693 . . . . 74.3 110.914 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 124.17 10.84 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.691 2.261 . . . . 75.24 112.33 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 46.8 mt . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.276 -0.42 . . . . 65.1 111.102 179.906 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.466 -0.12 0 CA-C-O 120.823 0.259 . . . . 72.45 112.312 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.22 -158.01 8.38 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.752 -0.737 . . . . 64.43 112.55 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.556 HD21 ' HB3' ' A' ' 36' ' ' TRP . 1.0 OUTLIER -124.92 125.01 43.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.89 0.376 . . . . 71.21 110.915 -179.933 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' VAL . . . . . 0.5 HG11 ' HB3' ' A' ' 39' ' ' ALA . 7.4 p -131.11 133.74 25.03 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-O 121.626 0.727 . . . . 71.2 111.12 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . 0.461 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.9 Cg_endo -69.73 153.19 69.36 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.669 2.246 . . . . 72.44 112.365 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.814 HG12 ' HB ' ' A' ' 71' ' ' THR . 4.6 t -74.39 -21.14 17.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 71.35 111.151 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.9 m -76.59 -3.28 36.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 74.42 110.852 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -125.97 21.29 7.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.148 -0.478 . . . . 73.42 110.946 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' VAL . . . . . 0.625 HG22 ' HA ' ' A' ' 52' ' ' VAL . 10.4 m -148.87 167.0 3.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.086 -0.506 . . . . 52.54 111.146 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.792 ' HB2' HD11 ' A' ' 7' ' ' LEU . 39.8 ttm-85 -138.35 119.68 14.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 64.04 110.811 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 38.8 mm -70.29 108.8 2.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.183 -0.462 . . . . 64.41 111.154 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ILE . . . . . 0.497 HG23 ' HG2' ' A' ' 56' ' ' ARG . 2.2 pt -128.31 140.3 49.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.459 . . . . 72.42 111.122 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -78.76 121.91 25.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.187 -0.46 . . . . 74.53 110.848 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.699 HD23 ' CG ' ' A' ' 3' ' ' PHE . 0.2 OUTLIER -53.5 -30.02 39.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.157 -0.474 . . . . 72.23 110.892 -179.976 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.404 ' HE3' ' HB3' ' A' ' 60' ' ' LEU . 14.3 mmt -85.36 -26.07 26.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 73.44 110.865 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -148.95 77.72 9.14 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.665 0.745 . . . . 64.41 110.884 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' PRO . . . . . 0.737 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 54.1 Cg_endo -69.7 -7.95 22.35 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.696 2.264 . . . . 72.2 112.376 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.42 -5.98 45.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.203 -0.453 . . . . 71.31 111.15 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -84.03 -41.49 17.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 65.42 110.867 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' TYR . . . . . 0.677 ' O ' HG12 ' A' ' 69' ' ' VAL . 23.4 m-85 -111.72 23.67 13.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.213 -0.449 . . . . 73.2 110.957 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ALA . . . . . 0.737 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -81.34 -13.4 58.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.09 -0.505 . . . . 73.23 111.13 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.4 t -102.85 -22.22 13.91 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 64.15 110.825 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' VAL . . . . . 0.943 HG21 HD11 ' A' ' 80' ' ' ILE . 9.9 p -51.18 156.61 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.108 -0.496 . . . . 73.25 111.097 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -114.25 107.43 15.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 65.53 110.867 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.814 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -70.8 -25.8 63.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.153 -0.476 . . . . 42.22 111.145 -179.879 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -62.97 -47.67 82.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.225 -0.443 . . . . 72.33 110.918 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -63.83 110.16 1.99 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.136 -0.484 . . . . 65.3 110.87 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.31 -27.61 24.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 73.25 110.855 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -66.96 -54.36 22.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.445 . . . . 52.05 110.87 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -59.77 -55.75 30.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 74.34 110.878 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' VAL . . . . . 0.528 ' HA ' HD12 ' A' ' 80' ' ' ILE . 5.4 p -54.05 -32.81 23.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.209 -0.451 . . . . 62.54 111.168 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 15.0 mtm -67.15 -53.83 26.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.128 -0.487 . . . . 74.31 110.872 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.0 mttm -56.52 -38.37 71.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 74.21 110.891 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.943 HD11 HG21 ' A' ' 69' ' ' VAL . 16.5 mt -65.29 -52.95 45.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.456 . . . . 65.32 111.088 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' ILE . . . . . 0.788 HG23 ' HB ' ' A' ' 86' ' ' ILE . 94.7 mt -62.01 -36.48 74.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 64.51 111.151 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -70.19 -46.78 63.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.147 -0.479 . . . . 72.31 110.804 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -63.53 -53.64 48.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 61.21 110.878 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.2 m-85 -68.03 -14.8 63.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.132 -0.486 . . . . 74.33 110.85 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 28.6 mmtm 60.78 55.49 3.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 72.13 110.93 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' ILE . . . . . 0.788 ' HB ' HG23 ' A' ' 81' ' ' ILE . 36.0 mt -82.5 131.98 53.72 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.601 0.715 . . . . 64.54 111.193 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' PRO . . . . . 0.416 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 53.4 Cg_endo -69.78 166.94 25.93 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.665 2.244 . . . . 65.54 112.316 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -97.33 168.01 10.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 73.31 111.154 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.2 t -51.41 -54.91 9.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 74.52 111.129 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -51.65 -52.06 50.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 74.12 110.846 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -57.02 -42.44 80.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 72.44 110.898 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -62.2 -39.39 92.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.218 -0.446 . . . . 74.33 110.932 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -65.12 -53.37 46.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.223 -0.444 . . . . 75.15 110.868 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -59.06 -37.23 76.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 43.41 110.872 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -64.4 -54.42 33.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 75.32 110.94 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.2 p . . . . . 0 C--N 1.33 -0.244 0 CA-C-N 116.208 -0.451 . . . . 70.53 111.171 -179.945 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.845 0.355 . . . . 74.02 110.886 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' -6' ' ' ILE . . . . . 0.747 HG23 ' OH ' ' A' ' 32' ' ' TYR . 3.9 mp 51.67 82.02 0.25 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.579 0.704 . . . . 71.25 111.163 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.71 117.88 5.35 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.649 2.232 . . . . 74.14 112.388 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 30.5 t -107.02 5.06 27.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.246 -0.433 . . . . 64.51 110.84 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 2.0 mpp_? -51.62 162.72 0.69 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.567 0.698 . . . . 73.14 110.888 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 -11.19 30.31 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.642 2.228 . . . . 71.11 112.32 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 63.82 82.3 0.21 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.611 0.719 . . . . 73.31 111.083 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 141.18 44.47 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.663 2.242 . . . . 73.24 112.332 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 22.1 mtmm -86.81 159.61 51.66 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.578 0.704 . . . . 65.1 110.89 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 166.9 26.04 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.658 2.239 . . . . 74.43 112.383 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo . . . . . 0 C--N 1.342 0.197 0 C-N-CA 122.696 2.264 . . . . 73.22 112.343 179.974 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 1.1 ptt? . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.797 0.332 . . . . 62.44 110.87 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . 0.568 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -97.79 160.22 29.07 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.619 0.723 . . . . 50.23 111.079 179.904 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.568 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 54.5 Cg_endo -69.7 79.31 0.93 Allowed 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 122.675 2.25 . . . . 62.14 112.372 179.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.738 HD11 HG13 ' A' ' 28' ' ' ILE . 0.5 OUTLIER -76.7 156.16 32.74 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.209 -0.451 . . . . 74.15 110.926 179.993 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.475 ' CE1' HD11 ' A' ' 60' ' ' LEU . 20.5 m-85 -133.22 146.11 51.17 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.211 -0.45 . . . . 73.41 110.949 179.905 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -122.56 153.47 39.21 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.187 -0.46 . . . . 61.0 111.103 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.557 HG23 ' O ' ' A' ' 24' ' ' GLU . 7.5 p -123.27 130.22 74.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.21 -0.45 . . . . 65.31 111.118 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.58 HG21 ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -72.26 138.17 47.27 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.195 -0.457 . . . . 52.23 111.182 -179.98 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.725 HD11 ' HB2' ' A' ' 56' ' ' ARG . 13.4 mt -112.44 -12.02 13.56 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.254 -0.43 . . . . 74.23 110.95 179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -137.69 154.81 49.62 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.185 -0.461 . . . . 74.23 110.931 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.1 tt0 -81.94 104.73 12.51 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.127 -0.488 . . . . 71.41 110.893 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -109.61 102.87 11.67 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 73.31 110.845 -179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp -78.99 136.32 37.18 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.162 -0.472 . . . . 70.12 110.88 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.32 161.2 11.85 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.2 -0.455 . . . . 63.13 111.102 179.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 pt-20 -124.6 -36.47 2.61 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.436 . . . . 44.12 110.936 -179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.2 mmp_? -132.45 -177.88 4.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.158 -0.474 . . . . 74.32 110.886 -179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 56.3 m-20 -65.67 -15.12 62.47 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.221 -0.445 . . . . 74.0 110.886 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.0 p-10 -99.03 22.34 10.45 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.21 -0.45 . . . . 64.43 110.878 179.994 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 13.0 mp0 -136.87 142.85 42.8 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.173 -0.467 . . . . 73.35 110.843 -179.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.551 HD11 HH12 ' A' ' 43' B ARG . 5.5 tp -121.36 126.45 49.45 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.145 -0.48 . . . . 61.44 110.946 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 5.6 p-10 -65.5 139.96 58.54 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.196 -0.457 . . . . 73.44 110.83 179.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.58 ' HB ' HG21 ' A' ' 6' ' ' THR . 0.4 OUTLIER -142.47 158.44 19.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.175 -0.466 . . . . 63.41 111.17 179.965 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -127.17 159.85 62.87 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.649 0.738 . . . . 61.31 110.83 -179.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 117.78 5.29 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.659 2.239 . . . . 72.24 112.373 179.946 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.5 7.12 30.47 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.718 -0.753 . . . . 44.45 112.448 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.557 ' O ' HG23 ' A' ' 5' ' ' VAL . 22.2 mm-40 -91.91 162.49 14.39 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.857 0.36 . . . . 74.13 110.908 -179.879 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.5 m120 -107.96 119.42 39.42 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.17 -0.468 . . . . 74.04 110.897 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.778 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 5.5 mt -120.98 154.29 36.19 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.195 -0.457 . . . . 73.25 110.946 179.941 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -109.03 115.94 31.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.159 -0.473 . . . . 65.33 110.844 -179.912 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.738 HG13 HD11 ' A' ' 2' ' ' LEU . 35.4 mm -70.57 143.32 14.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.154 -0.476 . . . . 53.53 111.149 179.908 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.9 m -124.5 -37.13 2.54 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.202 -0.454 . . . . 71.23 110.887 179.957 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -168.87 170.62 9.0 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.19 -0.459 . . . . 40.54 111.093 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 2.7 p80 -123.89 174.51 7.51 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.237 -0.438 . . . . 73.34 110.873 179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 45.9 t80 -142.16 100.68 3.77 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 75.24 110.896 -179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 14.4 m-20 60.09 18.78 8.04 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.075 -0.511 . . . . 63.44 110.87 179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.616 ' HD2' HD12 ' A' ' 81' ' ' ILE . 36.4 m-85 65.45 23.95 11.93 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.218 -0.446 . . . . 75.15 110.942 -179.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.492 ' O ' HG23 ' A' ' 52' ' ' VAL . 0.4 OUTLIER -116.92 -41.31 3.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.098 -0.501 . . . . 74.3 110.866 -179.975 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.426 ' CD1' ' HB2' ' A' ' 35' ' ' GLU . 56.6 m95 -116.62 140.32 49.53 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.185 -0.461 . . . . 74.44 110.926 -179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.613 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -119.31 142.8 47.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.207 -0.451 . . . . 52.13 110.873 -179.951 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 23.5 mm -96.27 95.44 4.79 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.145 -0.48 . . . . 71.55 111.103 179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.778 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -109.06 136.38 48.67 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.185 -0.461 . . . . 60.41 111.099 179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.8 pttt -111.46 157.73 38.31 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.621 0.724 . . . . 74.23 110.908 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 135.53 30.58 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.701 2.268 . . . . 64.41 112.367 179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 79.3 mt -108.11 -39.36 4.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.26 -0.427 . . . . 75.52 111.152 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' A ASN . . . . . . . . . . . . . 9.4 m-80 -72.82 -69.1 0.43 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 73.01 110.922 179.897 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' B ARG . . . . . 0.551 HH12 HD11 ' A' ' 18' ' ' LEU . 16.7 ptt85 -80.05 178.79 7.98 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 70.03 110.863 -179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.407 HD23 ' HA ' ' A' ' 44' ' ' LEU . 12.1 mt -125.36 121.47 34.02 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 74.51 110.865 -179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -157.2 -71.62 0.01 OUTLIER Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.688 -0.768 . . . . 42.52 112.477 179.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 167.76 165.32 24.96 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.752 -0.737 . . . . 23.12 112.486 -179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.83 147.63 62.84 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.642 2.228 . . . . 73.3 112.327 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.22 -143.29 4.85 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.771 -0.728 . . . . 54.14 112.504 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.412 HD11 ' HD3' ' B' ' -5' ' ' PRO . 0.2 OUTLIER -146.17 124.86 12.54 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.893 0.378 . . . . 61.1 110.899 -179.968 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.442 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.3 p -136.18 133.87 19.82 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.635 0.731 . . . . 74.22 111.14 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.442 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.8 Cg_endo -69.76 153.18 69.22 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.664 2.243 . . . . 72.24 112.352 179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.782 HG12 ' HB ' ' A' ' 71' ' ' THR . 11.1 t -66.34 -21.74 29.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.245 -0.434 . . . . 72.22 111.164 179.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 1.1 m -77.94 -1.93 34.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.154 -0.475 . . . . 72.31 110.871 -179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -126.84 22.91 6.73 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.137 -0.483 . . . . 73.11 110.934 -179.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.559 HG22 ' HA ' ' A' ' 52' ' ' VAL . 16.8 m -150.23 165.18 3.03 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.1 -0.5 . . . . 74.51 111.181 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.725 ' HB2' HD11 ' A' ' 7' ' ' LEU . 40.0 ttp85 -133.5 114.02 13.13 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.233 -0.44 . . . . 74.51 110.865 -179.963 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 29.1 mm -69.37 127.34 31.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.16 -0.473 . . . . 74.32 111.129 179.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.444 HG21 ' NH1' ' A' ' 56' ' ' ARG . 24.7 pt -143.49 -178.22 1.03 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.14 -0.482 . . . . 73.41 111.132 179.853 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 15.0 t0 -131.44 132.67 44.5 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.174 -0.467 . . . . 62.12 110.838 179.857 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.475 HD11 ' CE1' ' A' ' 3' ' ' PHE . 57.6 mt -59.28 -21.84 60.26 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 73.43 110.974 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 7.1 mtm -90.04 -30.21 17.89 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.14 -0.482 . . . . 74.22 110.903 179.786 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -152.19 75.69 7.27 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.584 0.707 . . . . 74.45 110.855 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.713 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.3 Cg_endo -69.82 -11.12 30.11 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.64 2.226 . . . . 74.1 112.308 -179.952 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.07 -5.56 47.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.241 -0.436 . . . . 65.22 111.107 179.869 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.3 ttmm -83.06 -51.12 7.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.203 -0.453 . . . . 63.11 110.916 179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.614 ' O ' HG12 ' A' ' 69' ' ' VAL . 88.6 m-85 -99.76 23.23 9.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.232 -0.44 . . . . 64.34 110.921 -179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.713 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -87.03 -20.88 26.55 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.136 -0.484 . . . . 65.44 111.118 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.0 t -92.85 -21.06 20.09 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.2 -0.455 . . . . 72.43 110.865 -179.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 1.052 HG21 HD11 ' A' ' 80' ' ' ILE . 7.6 p -51.55 152.27 0.74 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.11 -0.495 . . . . 72.34 111.151 179.917 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 33.5 m-20 -104.18 91.33 3.89 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.186 -0.461 . . . . 42.25 110.903 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.782 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -51.6 -35.66 42.49 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.237 -0.438 . . . . 73.33 111.136 -179.864 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 9.6 t80 -58.02 -43.98 87.04 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.221 -0.445 . . . . 72.0 110.969 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -63.83 107.98 1.35 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.094 -0.503 . . . . 61.01 110.846 179.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.28 -28.46 19.01 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.189 -0.46 . . . . 75.54 110.851 -179.86 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 11.5 mt-10 -66.73 -55.0 17.05 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 63.24 110.896 -179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.3 mt-30 -59.58 -56.35 23.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.152 -0.476 . . . . 74.21 110.891 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.401 HG21 HG11 ' A' ' 52' ' ' VAL . 4.2 p -53.44 -32.34 20.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.185 -0.461 . . . . 74.41 111.152 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 9.8 mtm -67.41 -54.51 19.76 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.163 -0.471 . . . . 61.12 110.879 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.83 -37.91 69.31 Favored 'General case' 0 C--N 1.327 -0.373 0 CA-C-N 116.263 -0.426 . . . . 71.1 110.863 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 1.052 HD11 HG21 ' A' ' 69' ' ' VAL . 84.4 mt -66.12 -53.46 36.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.197 -0.456 . . . . 71.13 111.155 179.855 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.76 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.4 mt -61.86 -36.21 72.51 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.189 -0.459 . . . . 73.23 111.124 179.839 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 61.1 t0 -71.05 -48.26 53.76 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.158 -0.474 . . . . 51.3 110.864 179.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 32.2 mt-10 -60.88 -53.89 51.78 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.198 -0.455 . . . . 73.44 110.896 -179.925 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.2 m-85 -69.21 -11.96 61.26 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.154 -0.475 . . . . 70.31 110.9 -179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 43.8 mmtt 58.45 54.53 5.49 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 72.43 110.872 179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.76 ' HB ' HG23 ' A' ' 81' ' ' ILE . 20.5 mt -81.06 131.61 59.08 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.638 0.733 . . . . 72.45 111.094 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 159.04 54.84 Favored 'Trans proline' 0 C--O 1.232 0.206 0 C-N-CA 122.675 2.25 . . . . 64.05 112.384 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -92.84 170.0 10.03 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.29 -0.414 . . . . 73.01 111.188 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.692 HG11 ' O ' ' B' ' -7' ' ' PHE . 98.4 t -52.04 -58.07 2.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.28 -0.418 . . . . 65.24 111.074 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -51.54 -51.86 51.86 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.207 -0.451 . . . . 64.11 110.881 -179.982 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 51.5 mm-40 -57.23 -38.56 73.97 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.136 -0.484 . . . . 64.41 110.971 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 24.2 t90 -66.39 -43.3 86.23 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.169 -0.469 . . . . 63.3 110.929 179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.2 mmpt? -61.54 -47.92 83.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.204 -0.453 . . . . 44.41 110.927 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 34.5 t0 -64.69 -39.93 94.5 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.24 -0.436 . . . . 73.23 110.886 179.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -60.39 -49.24 78.38 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.2 -0.454 . . . . 74.43 110.94 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -66.07 -41.84 90.2 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.222 -0.444 . . . . 75.04 111.121 -179.937 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 17.6 mmt180 -59.81 -48.62 80.94 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.227 -0.442 . . . . 73.21 110.865 -179.954 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 12.2 ptp180 -72.11 -32.63 67.14 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.186 -0.461 . . . . 54.43 110.848 -179.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 27.3 t80 -67.65 -33.93 75.93 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.217 -0.447 . . . . 71.01 110.904 -179.824 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 12.6 mmmt -73.82 -25.65 60.2 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.137 -0.483 . . . . 73.22 110.938 179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.4 mm-40 -63.43 179.24 0.46 Allowed 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.228 -0.442 . . . . 70.02 110.881 179.977 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 24.2 m -87.15 120.73 28.73 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.181 -0.463 . . . . 73.15 110.864 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 51.7 p -165.29 -174.53 3.25 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.126 -0.488 . . . . 70.21 110.843 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 23.4 mm -67.23 150.25 11.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.133 -0.485 . . . . 63.03 111.137 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.601 ' O ' HD13 ' A' ' 106' ' ' ILE . 9.2 pt20 -173.96 -178.83 1.59 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.456 . . . . 75.02 110.899 179.935 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.601 HD13 ' O ' ' A' ' 105' ' ' GLN . 28.7 mm -127.09 127.24 69.37 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 71.34 111.149 179.967 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -71.95 -34.12 62.21 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.715 -0.755 . . . . 62.21 112.48 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -59.71 139.68 57.06 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.887 0.375 . . . . 74.53 110.882 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 131.98 124.12 2.53 Favored Glycine 0 N--CA 1.451 -0.331 0 C-N-CA 120.754 -0.736 . . . . 32.23 112.507 -179.993 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -139.99 133.42 30.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.798 0.332 . . . . 74.42 110.875 -179.93 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -131.44 154.57 20.94 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.672 -0.775 . . . . 51.51 112.477 -179.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 88.4 mt-30 -148.68 171.73 15.73 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.811 0.338 . . . . 72.32 110.932 -179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 74.1 m -106.39 144.14 33.5 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.215 -0.448 . . . . 73.44 110.825 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 74.3 mm-40 -65.03 177.26 1.03 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.123 -0.49 . . . . 73.54 110.899 -179.92 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -176.52 109.37 0.28 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.769 -0.729 . . . . 43.34 112.512 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 27.9 mt -130.34 162.83 28.18 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.75 0.31 . . . . 72.2 110.944 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 24.8 tt0 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 74.33 110.885 179.91 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.325 0 N-CA-C 112.498 -0.241 . . . . 73.33 112.498 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER 63.89 26.99 14.4 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.801 0.334 . . . . 63.24 110.913 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' -7' ' ' PHE . . . . . 0.692 ' O ' HG11 ' A' ' 89' ' ' VAL . 38.8 m-85 -137.45 56.82 1.76 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.234 -0.439 . . . . 53.03 110.891 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 26.7 mm -110.82 81.64 2.65 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.631 0.729 . . . . 71.53 111.087 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' -5' ' ' PRO . . . . . 0.412 ' HD3' HD11 ' A' ' 49' ' ' LEU . 54.2 Cg_endo -69.74 78.46 1.0 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.667 2.245 . . . . 74.42 112.333 179.83 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 29.7 m -82.5 0.31 43.03 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.254 -0.43 . . . . 71.03 110.857 -179.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 2.1 mpp_? -67.63 162.17 59.57 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.552 0.692 . . . . 64.14 110.864 -179.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 158.88 55.48 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.651 2.234 . . . . 55.45 112.411 179.969 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -91.37 111.94 51.51 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.55 0.69 . . . . 72.12 111.101 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 149.84 67.23 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.65 2.233 . . . . 70.01 112.355 -179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 17.0 mtmt -99.89 161.18 25.18 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.598 0.713 . . . . 73.21 110.913 179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 168.25 22.07 Favored 'Trans proline' 0 C--N 1.342 0.219 0 C-N-CA 122.7 2.267 . . . . 55.11 112.336 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 87.82 0.55 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.627 2.218 . . . . 71.14 112.368 179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 26.2 p -153.85 157.82 39.88 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.173 -0.467 . . . . 63.23 110.882 -179.802 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 55.9 m -83.87 97.92 9.47 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.198 -0.456 . . . . 75.42 110.88 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.296 0 CA-C-N 116.097 -0.501 . . . . 75.04 111.096 179.944 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 7.4 ptm . . . . . 0 C--O 1.231 0.089 0 CA-C-O 120.804 0.335 . . . . 72.33 110.85 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . 0.435 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -131.8 156.22 80.39 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.573 0.702 . . . . 72.44 111.092 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.435 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 54.0 Cg_endo -69.72 77.46 1.06 Allowed 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.681 2.254 . . . . 63.03 112.34 179.993 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.519 ' H ' HD23 ' A' ' 2' ' ' LEU . 1.3 pt? -72.94 145.03 47.07 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.247 -0.433 . . . . 75.22 110.917 179.937 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.72 ' CD1' HD23 ' A' ' 60' ' ' LEU . 63.8 m-85 -115.26 153.68 30.46 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.178 -0.464 . . . . 62.4 110.892 179.914 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -129.47 152.88 48.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 72.03 111.14 179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.453 HG13 ' HB3' ' A' ' 56' ' ' ARG . 6.1 p -120.49 125.65 74.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.261 -0.427 . . . . 51.1 111.127 179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.725 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -66.95 131.39 45.78 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.172 -0.467 . . . . 75.05 111.105 -179.936 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.616 HD11 ' HB2' ' A' ' 56' ' ' ARG . 71.3 mt -102.36 -17.87 15.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.181 -0.463 . . . . 75.44 110.918 179.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.0 m-85 -133.96 157.14 46.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 75.54 110.963 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -82.55 105.28 13.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.14 -0.482 . . . . 74.21 110.878 -179.979 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 15.3 t80 -84.64 105.05 15.15 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.117 -0.492 . . . . 72.22 110.88 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 11.5 mttp -81.22 97.82 7.8 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.188 -0.46 . . . . 74.14 110.871 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.36 140.35 22.22 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.232 -0.44 . . . . 54.51 111.106 179.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 -107.06 -28.86 9.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.247 -0.433 . . . . 63.34 110.89 -179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 18.2 mmt180 -129.77 -179.25 5.08 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.466 . . . . 70.44 110.868 -179.892 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 46.6 m-20 -65.02 -36.9 85.88 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.203 -0.453 . . . . 70.21 110.859 179.998 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.1 m-20 -63.25 -34.91 78.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.167 -0.47 . . . . 70.14 110.88 179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -77.16 140.7 40.26 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.179 -0.464 . . . . 72.13 110.922 -179.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 12.3 tp -112.54 127.2 56.0 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.155 -0.475 . . . . 74.05 110.937 -179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 13.6 p-10 -72.89 125.22 27.07 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.247 -0.433 . . . . 74.32 110.838 179.846 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.725 ' CG1' HG21 ' A' ' 6' ' ' THR . 10.1 p -138.78 152.65 24.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.187 -0.46 . . . . 74.23 111.106 -179.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -114.41 159.64 35.98 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.673 0.749 . . . . 74.34 110.859 -179.837 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 123.18 9.83 Favored 'Trans proline' 0 C--N 1.341 0.143 0 C-N-CA 122.672 2.248 . . . . 73.13 112.346 179.978 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.09 4.53 31.12 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.696 -0.764 . . . . 60.44 112.47 -179.995 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.407 ' O ' HG23 ' A' ' 5' ' ' VAL . 23.3 mm-40 -92.01 165.1 13.36 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-O 120.842 0.353 . . . . 72.15 110.91 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.654 ' HB3' HD12 ' A' ' 42' ' ' ILE . 7.9 m120 -110.75 128.37 55.71 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.151 -0.477 . . . . 72.22 110.915 -179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.74 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 2.1 mt -128.24 146.48 50.72 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.188 -0.46 . . . . 71.42 110.902 179.992 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -96.25 123.26 39.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.181 -0.463 . . . . 74.22 110.891 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 34.3 mm -70.12 144.49 13.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.169 -0.468 . . . . 63.42 111.146 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 21.8 m -125.77 -37.48 2.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.464 . . . . 74.33 110.879 179.941 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -179.11 171.54 1.34 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.185 -0.461 . . . . 41.54 111.121 -179.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.549 ' O ' HG22 ' A' ' 88' ' ' THR . 2.7 p80 -124.25 176.85 6.16 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.232 -0.44 . . . . 71.44 110.876 -179.985 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.402 ' HB3' ' HB2' ' A' ' 36' ' ' TRP . 29.5 t80 -148.03 102.78 3.42 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.269 -0.423 . . . . 73.31 110.942 -179.882 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 60.16 18.64 8.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.139 -0.482 . . . . 74.54 110.883 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.605 ' HD2' HD12 ' A' ' 81' ' ' ILE . 44.2 m-85 61.79 20.23 11.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.182 -0.463 . . . . 75.3 110.922 -179.836 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.6 pt-20 -119.47 -3.81 10.41 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.113 -0.494 . . . . 64.4 110.863 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.512 ' HB3' HD21 ' A' ' 49' ' ' LEU . 90.5 m95 -151.57 135.8 16.74 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.148 -0.478 . . . . 75.01 110.893 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.6 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -120.06 145.64 46.67 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.231 -0.44 . . . . 70.44 110.887 179.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.8 mm -100.83 95.12 3.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.122 -0.49 . . . . 75.14 111.119 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.74 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.18 134.91 51.73 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.169 -0.469 . . . . 71.34 111.107 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 22.8 pttt -111.34 156.75 40.68 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.59 0.71 . . . . 73.2 110.885 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 115.44 4.1 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.722 2.281 . . . . 73.54 112.313 179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.654 HD12 ' HB3' ' A' ' 25' ' ' ASN . 55.1 mt -72.35 -34.72 49.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.177 -0.465 . . . . 52.4 111.142 179.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' A ASN . . . . . . . . . . . . . 8.5 t30 -89.22 -57.01 3.04 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.148 -0.478 . . . . 74.43 110.886 179.894 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' B ARG . . . . . . . . . . . . . 27.8 mtm-85 -67.55 149.01 50.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 74.42 110.86 -179.934 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.07 12.42 32.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.181 -0.463 . . . . 70.32 110.927 -179.978 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -51.79 -86.37 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.261 0 C-N-CA 120.737 -0.744 . . . . 54.31 112.462 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -179.46 165.71 34.59 Favored Glycine 0 N--CA 1.45 -0.369 0 C-N-CA 120.773 -0.727 . . . . 61.01 112.502 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 146.07 58.89 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.658 2.239 . . . . 64.14 112.31 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -133.68 -156.8 8.09 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.744 -0.741 . . . . 41.23 112.496 179.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.512 HD21 ' HB3' ' A' ' 36' ' ' TRP . 1.7 tt -131.11 124.86 31.66 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.797 0.332 . . . . 61.35 110.953 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.442 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.3 p -137.23 133.46 18.37 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.613 0.72 . . . . 72.45 111.13 179.85 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.442 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.7 Cg_endo -69.75 155.63 65.46 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.644 2.23 . . . . 63.1 112.341 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.801 HG12 ' HB ' ' A' ' 71' ' ' THR . 9.4 t -68.39 -21.44 26.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.211 -0.45 . . . . 74.43 111.134 179.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -77.24 -3.06 37.82 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.152 -0.476 . . . . 63.23 110.837 -179.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 35.0 m-85 -124.89 19.91 8.44 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.131 -0.486 . . . . 73.15 110.882 -179.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.571 HG22 ' HA ' ' A' ' 52' ' ' VAL . 17.0 m -150.24 157.41 6.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.111 -0.495 . . . . 54.1 111.094 179.909 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.616 ' HB2' HD11 ' A' ' 7' ' ' LEU . 22.4 ttp180 -123.93 110.77 15.24 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.166 -0.47 . . . . 72.11 110.853 -179.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.502 HG21 HG21 ' A' ' 80' ' ' ILE . 38.9 mm -64.69 121.37 13.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.197 -0.456 . . . . 60.41 111.135 179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.423 HG23 ' HG2' ' A' ' 56' ' ' ARG . 14.8 pt -136.18 173.41 13.92 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.368 0 CA-C-N 116.172 -0.467 . . . . 73.12 111.16 179.819 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.9 m-20 -115.92 126.33 53.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 74.51 110.839 179.848 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.72 HD23 ' CD1' ' A' ' 3' ' ' PHE . 0.2 OUTLIER -52.49 -29.34 24.44 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.197 -0.456 . . . . 74.31 110.95 -179.984 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.82 -26.01 19.62 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.216 -0.447 . . . . 73.42 110.9 179.802 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -141.61 73.76 23.91 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.611 0.72 . . . . 74.43 110.878 179.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.594 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 54.0 Cg_endo -69.77 -8.97 24.97 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.691 2.26 . . . . 72.22 112.387 -179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -102.67 -17.61 15.58 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.177 -0.465 . . . . 74.33 111.116 179.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.9 ttmm -73.44 -51.9 15.59 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.174 -0.466 . . . . 73.11 110.918 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.557 ' O ' HG12 ' A' ' 69' ' ' VAL . 81.5 m-85 -95.43 23.03 6.29 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.226 -0.443 . . . . 75.12 110.948 179.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.594 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -86.99 -19.96 27.95 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.118 -0.492 . . . . 73.22 111.075 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 8.2 p -88.67 -19.92 25.55 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.228 -0.442 . . . . 50.34 110.822 -179.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 1.062 HG21 HD11 ' A' ' 80' ' ' ILE . 7.0 p -51.53 148.28 1.29 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.164 -0.471 . . . . 70.41 111.125 179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 21.9 m-20 -105.82 89.44 3.08 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.211 -0.449 . . . . 75.15 110.862 179.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.801 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.5 OUTLIER -51.32 -30.38 18.15 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.218 -0.446 . . . . 62.51 111.169 -179.952 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -61.25 -48.5 81.16 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.187 -0.46 . . . . 65.01 110.909 -179.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -63.85 112.57 2.96 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.159 -0.473 . . . . 75.11 110.877 179.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.42 -24.64 31.56 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.155 -0.475 . . . . 54.54 110.887 -179.902 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -66.9 -54.01 26.43 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.221 -0.445 . . . . 74.44 110.885 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 3.2 mm100 -59.83 -57.89 10.94 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.13 -0.486 . . . . 73.45 110.876 -179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.622 HG21 HG11 ' A' ' 52' ' ' VAL . 2.0 p -51.88 -32.21 14.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.215 -0.448 . . . . 74.52 111.144 179.938 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 9.9 mtm -68.11 -53.22 26.89 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 65.31 110.855 179.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.9 mttm -55.75 -38.14 69.43 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.243 -0.435 . . . . 60.11 110.884 179.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 1.062 HD11 HG21 ' A' ' 69' ' ' VAL . 30.0 mt -66.65 -55.63 17.48 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.24 -0.436 . . . . 63.23 111.154 179.881 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.773 HG23 ' HB ' ' A' ' 86' ' ' ILE . 93.0 mt -59.98 -36.78 69.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.195 -0.457 . . . . 51.31 111.137 179.847 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -71.22 -52.08 21.04 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.184 -0.462 . . . . 40.41 110.854 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -60.21 -51.16 70.76 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.161 -0.472 . . . . 72.52 110.876 -179.912 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -70.03 -11.16 60.68 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.185 -0.461 . . . . 55.23 110.86 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 26.9 mmtt 58.12 49.19 11.81 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.184 -0.462 . . . . 74.1 110.856 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.773 ' HB ' HG23 ' A' ' 81' ' ' ILE . 14.2 mt -78.28 125.74 84.43 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.607 0.718 . . . . 70.04 111.13 179.869 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 158.3 57.43 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.682 2.255 . . . . 64.01 112.325 179.877 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.549 HG22 ' O ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -87.41 172.23 9.97 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 62.21 111.149 -179.993 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.9 t -52.28 -51.69 30.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.23 -0.441 . . . . 74.01 111.111 179.933 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -51.6 -51.97 51.31 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.186 -0.461 . . . . 71.22 110.859 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 43.0 mm-40 -58.13 -40.77 82.12 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.183 -0.462 . . . . 72.4 110.956 -179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 23.6 t90 -64.89 -40.5 95.21 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.19 -0.459 . . . . 73.33 110.945 -179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -63.69 -52.45 60.56 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.233 -0.439 . . . . 71.0 110.88 179.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -59.18 -43.97 92.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.215 -0.448 . . . . 74.13 110.849 179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 10.5 mm100 -59.38 -48.81 80.22 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.462 . . . . 72.34 110.873 -179.895 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 11.2 p -66.28 -38.75 88.52 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.23 -0.441 . . . . 54.3 111.142 -179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 12.2 mtm180 -60.75 -57.33 13.12 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.243 -0.435 . . . . 71.14 110.876 179.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 46.5 mtp180 -62.66 -39.09 92.81 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.19 -0.459 . . . . 73.31 110.852 -179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 17.3 t80 -59.44 -43.74 93.06 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.161 -0.472 . . . . 65.43 110.938 -179.83 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 13.6 mmtp -79.82 -25.46 40.83 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.097 -0.501 . . . . 65.41 110.91 179.908 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.3 mm-40 -79.88 -177.46 5.97 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.217 -0.447 . . . . 65.54 110.921 179.921 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.7 t 62.72 38.29 12.02 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.157 -0.474 . . . . 74.54 110.848 -179.812 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 89.6 p -82.63 -169.39 2.44 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.128 -0.487 . . . . 55.52 110.856 -179.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.446 HG22 ' N ' ' A' ' 105' ' ' GLN . 10.0 mt -79.59 158.59 4.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.085 -0.507 . . . . 72.24 111.146 179.962 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.446 ' N ' HG22 ' A' ' 104' ' ' ILE . 0.0 OUTLIER -48.96 164.92 0.06 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.175 -0.466 . . . . 75.24 110.921 179.91 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 23.2 mm -118.7 151.11 20.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.326 0 CA-C-N 116.179 -0.464 . . . . 43.01 111.124 179.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -100.67 -138.8 10.43 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.77 -0.728 . . . . 54.52 112.532 179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 16.6 t-20 -77.31 128.46 34.34 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.914 0.388 . . . . 65.22 110.881 -179.909 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -129.43 -72.11 0.13 Allowed Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.707 -0.758 . . . . 71.3 112.462 -179.989 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 20.1 m-70 -58.79 99.64 0.05 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.865 0.364 . . . . 74.51 110.873 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -85.12 -74.69 1.25 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.786 -0.721 . . . . 73.52 112.46 -179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 -162.74 121.03 2.09 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.798 0.332 . . . . 60.14 110.913 -179.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 44.9 m -86.59 171.96 10.62 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 72.41 110.857 -179.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -106.78 -26.65 11.19 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.12 -0.491 . . . . 72.42 110.916 -179.984 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 67.58 59.49 6.62 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.766 -0.731 . . . . 64.11 112.47 -179.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 82.0 mt -118.8 -46.98 2.53 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-O 120.825 0.345 . . . . 60.24 110.911 -179.903 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 22.0 tt0 . . . . . 0 C--N 1.33 -0.278 0 CA-C-N 116.188 -0.46 . . . . 75.04 110.902 179.941 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' -9' ' ' GLY . . . . . 0.49 ' N ' HD11 ' B' ' -6' ' ' ILE . . . . . . . . 0 N--CA 1.451 -0.336 0 N-CA-C 112.475 -0.25 . . . . 74.31 112.475 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -81.67 -30.41 32.69 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.769 0.319 . . . . 70.22 110.9 -179.971 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' -7' ' ' PHE . . . . . 0.501 ' HB3' HD12 ' A' ' 49' ' ' LEU . 66.9 m-85 -75.21 -75.0 0.18 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.266 -0.425 . . . . 74.45 110.887 179.934 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' -6' ' ' ILE . . . . . 0.49 HD11 ' N ' ' B' ' -9' ' ' GLY . 19.3 mm 51.81 77.08 0.48 Allowed Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.57 0.7 . . . . 74.51 111.127 179.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 92.36 0.51 Allowed 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.654 2.236 . . . . 74.15 112.368 179.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 29.1 t -89.44 3.54 51.99 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.216 -0.447 . . . . 45.01 110.861 -179.853 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.47 162.17 0.72 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.623 0.725 . . . . 74.02 110.861 -179.952 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 -16.16 37.65 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.653 2.236 . . . . 53.23 112.354 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.3 80.56 0.23 Allowed Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.617 0.723 . . . . 70.41 111.113 179.879 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 154.1 68.1 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.691 2.261 . . . . 52.1 112.335 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 3.7 mptp? -93.51 159.54 34.81 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.555 0.693 . . . . 64.21 110.87 179.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 166.8 26.41 Favored 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.685 2.256 . . . . 75.2 112.315 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 -27.49 26.56 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.731 2.287 . . . . 60.24 112.332 179.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 47.5 t -104.23 97.54 7.48 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 74.33 110.894 -179.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 22.4 p -101.77 147.26 26.69 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.148 -0.478 . . . . 63.31 110.908 -179.864 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.459 . . . . 70.52 111.119 179.9 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 16.7 ptm . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.82 0.343 . . . . 73.15 110.87 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . 0.592 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -109.96 160.33 28.51 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.59 0.71 . . . . 52.43 111.087 179.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.592 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 54.0 Cg_endo -69.79 95.43 0.56 Allowed 'Trans proline' 0 C--O 1.232 0.202 0 C-N-CA 122.691 2.261 . . . . 64.05 112.348 179.978 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.583 ' CD1' HD12 ' A' ' 28' ' ' ILE . 1.4 pp -105.44 138.26 41.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.266 -0.424 . . . . 53.04 110.938 179.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.608 ' CE1' HD12 ' A' ' 60' ' ' LEU . 19.0 m-85 -118.49 152.05 36.68 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.2 -0.454 . . . . 70.11 110.869 179.983 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 1.049 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -120.06 163.14 18.1 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.175 -0.466 . . . . 73.15 111.13 179.888 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.416 ' O ' HG13 ' A' ' 5' ' ' VAL . 5.6 p -133.75 119.26 32.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.245 -0.434 . . . . 74.32 111.132 179.972 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.732 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -67.14 139.19 57.47 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.187 -0.461 . . . . 73.12 111.127 -179.962 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 6.0 mt -106.02 -18.37 14.05 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.265 -0.425 . . . . 61.01 110.941 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 46.9 m-85 -139.06 163.9 31.19 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.168 -0.469 . . . . 71.12 110.945 179.965 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.9 tp10 -80.44 113.45 18.63 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.114 -0.494 . . . . 73.11 110.908 179.994 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 20.7 t80 -98.17 111.57 23.85 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.217 -0.447 . . . . 74.32 110.853 -179.908 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.05 121.01 26.01 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.121 -0.491 . . . . 73.42 110.906 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.446 ' HB1' ' HB3' ' A' ' 17' ' ' GLU . . . -74.93 156.53 36.25 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.232 -0.44 . . . . 54.12 111.126 179.837 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -124.18 -37.69 2.53 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.257 -0.429 . . . . 63.14 110.891 -179.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.7 mmt180 -128.85 178.92 6.03 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.179 -0.464 . . . . 71.34 110.87 -179.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 8.7 t70 -55.84 -44.54 78.08 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.2 -0.455 . . . . 74.14 110.872 -179.998 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 53.4 m-20 -54.54 -51.91 63.7 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.194 -0.457 . . . . 75.51 110.883 179.978 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.446 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 0.1 OUTLIER -60.55 147.94 39.74 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.153 -0.476 . . . . 74.05 110.858 -179.896 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.3 tp -128.82 120.81 26.99 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.168 -0.469 . . . . 72.1 110.951 179.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -66.47 137.46 56.84 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.187 -0.461 . . . . 75.23 110.859 179.84 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.732 ' CG1' HG21 ' A' ' 6' ' ' THR . 7.2 p -153.15 146.07 14.8 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.177 -0.465 . . . . 72.43 111.09 -179.976 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.6 m -103.42 160.47 26.04 Favored Pre-proline 0 C--N 1.33 -0.255 0 CA-C-O 121.735 0.779 . . . . 71.42 110.825 -179.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.79 118.36 5.64 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.685 2.257 . . . . 73.25 112.334 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.02 5.02 31.08 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.717 -0.754 . . . . 72.33 112.499 -179.996 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -92.18 156.87 17.03 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.893 0.378 . . . . 73.42 110.899 -179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.498 ' CB ' HD12 ' A' ' 42' ' ' ILE . 4.7 m120 -104.45 133.76 48.79 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.152 -0.476 . . . . 72.01 110.864 -179.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.544 HD11 HG21 ' A' ' 20' ' ' VAL . 4.4 mp -133.82 149.47 51.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.156 -0.475 . . . . 73.33 110.929 179.954 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 1.8 t -100.86 112.59 25.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.232 -0.44 . . . . 53.23 110.869 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 1.049 HD11 ' HB2' ' A' ' 4' ' ' ALA . 57.5 mt -77.02 150.83 5.84 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.133 -0.485 . . . . 73.11 111.15 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 34.0 m -125.85 -36.69 2.36 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.188 -0.46 . . . . 74.0 110.858 179.952 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -159.0 179.2 9.29 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.198 -0.456 . . . . 55.33 111.069 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.712 ' O ' HG23 ' A' ' 89' ' ' VAL . 1.5 p80 -132.82 178.21 7.04 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.182 -0.463 . . . . 71.25 110.806 -179.967 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.6 t80 -137.8 99.09 3.82 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.167 -0.47 . . . . 72.44 110.947 -179.847 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.9 t70 53.07 26.54 4.94 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.167 -0.469 . . . . 71.41 110.862 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.592 ' HD2' HD12 ' A' ' 81' ' ' ILE . 23.4 m-85 62.85 26.06 15.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 64.42 110.903 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.433 ' O ' HG23 ' A' ' 52' ' ' VAL . 12.2 mm-40 -114.48 -40.27 3.65 Favored 'General case' 0 C--N 1.33 -0.257 0 CA-C-N 116.13 -0.487 . . . . 74.25 110.894 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 79.2 m95 -122.3 155.48 35.86 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.12 -0.491 . . . . 73.41 110.95 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.759 ' CD2' HG22 ' A' ' 52' ' ' VAL . 2.4 m-85 -128.19 130.83 48.62 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.201 -0.454 . . . . 64.45 110.855 -179.889 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.663 HG23 ' O ' ' A' ' 48' ' ' GLY . 19.0 mm -91.33 94.12 4.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 64.34 111.128 179.961 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . . . . . . . . . . . -116.23 157.07 25.46 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.169 -0.469 . . . . 70.33 111.116 179.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 6.3 pttp -123.25 156.84 62.8 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.564 0.697 . . . . 74.31 110.9 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.74 127.85 15.2 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.664 2.243 . . . . 74.41 112.401 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.498 HD12 ' CB ' ' A' ' 25' ' ' ASN . 60.1 mt -84.87 -44.02 17.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.222 -0.445 . . . . 72.51 111.11 179.985 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' A ASN . . . . . . . . . . . . . 25.4 m120 -91.21 -47.58 7.43 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.151 -0.477 . . . . 72.33 110.883 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' B ARG . . . . . . . . . . . . . 14.2 mtp180 -66.3 -170.77 0.1 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.242 -0.436 . . . . 70.33 110.902 179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.9 mt -129.32 122.72 30.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.186 -0.461 . . . . 71.25 110.932 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 179.95 -80.1 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.737 -0.744 . . . . 74.32 112.467 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 139.96 -165.28 25.97 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.705 -0.76 . . . . 73.54 112.496 -179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 134.7 28.58 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.645 2.23 . . . . 54.32 112.373 -179.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.663 ' O ' HG23 ' A' ' 38' ' ' ILE . . . -136.83 -120.51 1.95 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.713 -0.756 . . . . 54.41 112.443 180.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -159.45 125.9 4.47 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.832 0.348 . . . . 73.34 110.891 -179.926 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.694 HG21 HG21 ' A' ' 55' ' ' VAL . 3.0 m -136.47 138.88 27.94 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.606 0.717 . . . . 65.53 111.134 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 130.01 18.57 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.664 2.243 . . . . 70.12 112.369 179.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.759 HG22 ' CD2' ' A' ' 37' ' ' PHE . 22.1 t -57.35 -21.69 15.86 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.21 -0.45 . . . . 71.24 111.132 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 2.4 p -74.34 -6.26 47.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.189 -0.46 . . . . 53.33 110.888 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 11.6 m-85 -119.52 -25.27 6.05 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.101 -0.5 . . . . 72.52 110.893 -179.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.868 HG13 ' HB1' ' A' ' 4' ' ' ALA . 1.3 t -106.16 138.69 30.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.145 -0.48 . . . . 73.3 111.105 179.959 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 21.8 ttp180 -111.2 123.64 50.61 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.147 -0.479 . . . . 64.22 110.855 -179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.739 HD11 ' CE2' ' A' ' 37' ' ' PHE . 24.2 mm -70.79 128.88 34.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.168 -0.469 . . . . 74.45 111.141 179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . . . . . . . . . 16.0 pt -145.69 174.12 3.06 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.166 -0.47 . . . . 61.11 111.129 179.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 35.2 t0 -117.84 130.19 56.12 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.186 -0.461 . . . . 74.44 110.872 179.868 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.608 HD12 ' CE1' ' A' ' 3' ' ' PHE . 3.8 mt -58.04 -22.73 51.35 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.201 -0.454 . . . . 71.24 110.895 -179.944 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.4 mmt -89.54 -27.93 19.95 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.215 -0.448 . . . . 73.53 110.899 179.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.5 t0 -152.58 75.84 6.95 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.659 0.743 . . . . 73.5 110.857 179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.738 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.9 Cg_endo -69.78 -8.52 23.82 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.676 2.251 . . . . 63.12 112.313 -179.971 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.34 -15.33 24.49 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.262 -0.426 . . . . 71.53 111.128 179.864 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 11.8 ttmt -76.16 -52.04 10.92 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.446 . . . . 72.25 110.878 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.611 ' O ' HG12 ' A' ' 69' ' ' VAL . 57.6 m-85 -96.21 23.46 6.57 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.234 -0.439 . . . . 75.3 110.894 -179.947 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.738 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -87.58 -18.02 30.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.13 -0.486 . . . . 52.43 111.08 179.874 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.0 p -89.96 -23.79 21.45 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 71.2 110.853 -179.78 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.611 HG12 ' O ' ' A' ' 66' ' ' TYR . 8.2 p -53.32 139.17 11.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.129 -0.487 . . . . 74.53 111.097 179.979 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 28.2 m-20 -94.32 91.38 6.68 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 74.42 110.893 179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.747 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -51.3 -30.23 17.46 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.178 -0.465 . . . . 74.32 111.127 -179.866 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 11.9 t80 -58.95 -48.1 82.72 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.248 -0.433 . . . . 71.14 110.927 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -64.03 111.08 2.37 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.138 -0.483 . . . . 62.34 110.851 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.59 -24.76 34.64 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.166 -0.47 . . . . 74.43 110.874 -179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 9.6 mt-10 -66.79 -55.25 15.75 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.187 -0.461 . . . . 65.24 110.907 -179.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.52 ' O ' HD12 ' A' ' 80' ' ' ILE . 3.3 mt-30 -58.77 -58.32 9.14 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.129 -0.487 . . . . 70.43 110.909 -179.948 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 1.8 p -51.45 -31.46 12.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.175 -0.466 . . . . 75.4 111.091 -179.995 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.7 mtm -68.49 -51.58 41.71 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 73.23 110.879 179.944 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 32.8 mttt -56.36 -43.77 79.47 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.176 -0.466 . . . . 75.12 110.9 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.52 HD12 ' O ' ' A' ' 76' ' ' GLN . 1.7 mp -63.62 -56.05 19.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.194 -0.457 . . . . 65.35 111.116 179.885 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.646 HG23 ' HB ' ' A' ' 86' ' ' ILE . 85.2 mt -55.88 -37.16 46.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.302 0 CA-C-N 116.176 -0.465 . . . . 75.44 111.145 179.861 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 36.9 t70 -71.23 -51.99 21.53 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.157 -0.474 . . . . 72.54 110.829 179.91 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.7 mt-10 -58.5 -51.21 70.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.211 -0.45 . . . . 61.41 110.906 -179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -67.8 -14.77 63.23 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.146 -0.479 . . . . 64.1 110.883 -179.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.5 mmtt 61.09 52.83 3.84 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.095 -0.502 . . . . 75.22 110.931 179.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.646 ' HB ' HG23 ' A' ' 81' ' ' ILE . 37.3 mt -81.5 131.9 56.92 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.637 0.732 . . . . 74.43 111.103 179.917 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 153.45 68.74 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.659 2.24 . . . . 73.14 112.331 179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -89.63 165.96 13.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.168 -0.469 . . . . 73.24 111.139 -179.95 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.712 HG23 ' O ' ' A' ' 31' ' ' HIS . 86.1 t -51.24 -58.09 2.36 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 65.44 111.149 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -50.81 -51.2 53.23 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.176 -0.465 . . . . 73.02 110.892 -179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 55.5 mm-40 -57.12 -41.6 79.3 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.145 -0.479 . . . . 74.11 110.918 -179.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 29.3 t90 -65.37 -36.96 85.58 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.201 -0.454 . . . . 74.53 110.936 -179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.3 mmpp? -65.75 -50.08 66.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.219 -0.446 . . . . 74.31 110.875 179.923 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -61.62 -44.86 96.19 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.251 -0.431 . . . . 75.11 110.844 179.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 40.5 mm-40 -60.22 -47.56 85.46 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.216 -0.447 . . . . 73.32 110.914 -179.901 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 26.4 p -65.98 -47.42 74.62 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.192 -0.458 . . . . 74.31 111.122 -179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 18.9 mmm180 -53.58 -50.89 64.62 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.23 -0.441 . . . . 71.45 110.856 -179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 23.8 mtt-85 -69.71 -32.73 71.47 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.466 . . . . 74.13 110.854 -179.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 28.9 t80 -65.05 -37.62 88.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.197 -0.456 . . . . 74.44 110.889 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 38.5 mttt -84.96 -25.67 27.66 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.145 -0.48 . . . . 63.43 110.867 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -79.34 -177.97 5.99 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.245 -0.434 . . . . 61.14 110.892 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.5 m -107.72 107.96 18.97 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.156 -0.475 . . . . 71.14 110.843 -179.736 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 1.7 m -159.93 -178.37 6.98 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.171 -0.468 . . . . 72.51 110.872 -179.771 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 6.6 mm -104.36 161.28 4.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.128 -0.487 . . . . 63.21 111.105 179.966 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.549 ' O ' HD13 ' A' ' 106' ' ' ILE . 3.2 mt-30 -71.46 -169.32 0.4 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.169 -0.469 . . . . 72.1 110.891 179.968 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.549 HD13 ' O ' ' A' ' 105' ' ' GLN . 28.1 mm -139.91 94.49 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.187 -0.461 . . . . 73.53 111.118 179.969 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -129.83 118.02 2.48 Favored Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.719 -0.753 . . . . 71.31 112.47 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 4.3 t-20 -119.43 129.71 54.91 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.862 0.363 . . . . 75.54 110.833 -179.841 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -141.63 116.87 1.13 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.758 -0.734 . . . . 41.11 112.502 179.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 4.3 t-80 -136.97 56.67 1.79 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.896 0.379 . . . . 55.34 110.844 -179.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -138.79 -156.97 7.19 Favored Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.775 -0.726 . . . . 72.31 112.524 -179.987 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 4.1 tt0 -148.88 109.78 4.3 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.794 0.33 . . . . 75.33 110.895 -179.857 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -64.22 137.19 57.81 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 41.35 110.862 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 38.8 mm-40 -76.79 164.54 25.75 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.148 -0.478 . . . . 72.44 110.901 -179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -139.72 57.88 0.6 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.739 -0.743 . . . . 74.43 112.492 -179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -115.83 169.0 9.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.758 0.313 . . . . 70.23 110.957 -179.921 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 . . . . . 0 C--N 1.329 -0.291 0 CA-C-N 116.235 -0.438 . . . . 74.12 110.908 179.889 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' -9' ' ' GLY . . . . . 0.673 ' N ' HD11 ' B' ' -6' ' ' ILE . . . . . . . . 0 N--CA 1.451 -0.358 0 N-CA-C 112.476 -0.25 . . . . 64.3 112.476 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 51.4 mtpt -78.81 -66.25 0.89 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.811 0.338 . . . . 74.33 110.87 -179.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 27.6 m-85 -68.63 -71.33 0.22 Allowed 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.203 -0.453 . . . . 74.33 110.94 179.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' -6' ' ' ILE . . . . . 0.673 HD11 ' N ' ' B' ' -9' ' ' GLY . 24.3 mm 51.07 74.29 0.83 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.633 0.73 . . . . 73.4 111.115 179.932 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 127.98 15.35 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.655 2.237 . . . . 65.34 112.322 179.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -122.89 12.11 9.72 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.225 -0.443 . . . . 62.33 110.86 -179.844 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -51.69 162.43 0.74 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.595 0.712 . . . . 74.1 110.866 -179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.74 -11.34 30.66 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.69 2.26 . . . . 71.35 112.369 179.955 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 57.79 80.93 0.26 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.59 0.709 . . . . 72.4 111.08 179.874 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 144.04 52.64 Favored 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.703 2.269 . . . . 73.02 112.326 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 38.8 mtmt -80.29 160.87 66.94 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.544 0.687 . . . . 73.41 110.906 179.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 165.68 30.1 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.666 2.244 . . . . 63.1 112.344 179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.82 96.75 0.61 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.708 2.272 . . . . 52.22 112.309 179.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 1.5 m -115.06 -52.53 2.68 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 70.23 110.837 -179.831 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -136.3 116.05 13.05 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.157 -0.474 . . . . 70.34 110.845 -179.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.146 -0.479 . . . . 43.21 111.092 179.909 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.095 0 CA-C-O 120.781 0.325 . . . . 73.4 110.91 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . 0.575 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -51.48 160.66 0.95 Allowed Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.637 0.732 . . . . 63.31 111.077 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.575 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 54.0 Cg_endo -69.73 124.61 11.27 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.686 2.257 . . . . 61.04 112.352 179.983 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.681 HD21 HD11 ' A' ' 86' ' ' ILE . 0.0 OUTLIER -108.97 119.47 39.66 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.225 -0.443 . . . . 65.21 110.919 179.934 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.75 ' CZ ' HD12 ' A' ' 60' ' ' LEU . 81.0 m-85 -137.92 139.89 40.03 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.175 -0.466 . . . . 75.13 110.879 179.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.445 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -130.34 157.99 41.04 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.135 -0.484 . . . . 62.41 111.133 179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 24' ' ' GLU . 8.5 p -124.13 128.5 74.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.215 -0.448 . . . . 71.0 111.149 179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.682 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.2 OUTLIER -72.48 127.43 32.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.209 -0.45 . . . . 52.32 111.133 -179.934 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 34.3 mt -101.21 -18.66 16.05 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.204 -0.453 . . . . 63.02 110.913 179.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 13.5 m-85 -133.78 161.56 34.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 62.45 110.898 -179.953 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.9 tp10 -82.02 105.49 13.16 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.117 -0.492 . . . . 65.52 110.876 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 32.2 t80 -87.28 125.46 34.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.189 -0.46 . . . . 61.43 110.879 -179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -105.43 104.39 14.11 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.133 -0.485 . . . . 71.04 110.874 179.995 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.678 ' HB1' ' HB2' ' A' ' 17' ' ' GLU . . . -53.53 160.37 1.27 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.212 -0.449 . . . . 64.24 111.094 179.831 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 pt-20 -118.47 -32.22 4.68 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.219 -0.446 . . . . 74.5 110.879 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 16.6 mmt180 -124.09 -175.79 3.33 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 62.21 110.821 -179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -67.07 -38.93 86.62 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.189 -0.459 . . . . 64.12 110.852 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 -59.65 -53.1 61.99 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.231 -0.44 . . . . 75.24 110.844 179.986 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.678 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 5.2 mm-40 -54.24 164.65 0.63 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.218 -0.446 . . . . 74.33 110.862 -179.92 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.408 HD22 ' HD3' ' A' ' 41' ' ' PRO . 4.5 tp -139.46 142.8 37.35 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.125 -0.489 . . . . 73.44 110.868 -179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.7 t70 -86.6 143.09 27.82 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.176 -0.466 . . . . 71.23 110.848 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.682 ' CG1' HG21 ' A' ' 6' ' ' THR . 6.7 p -153.11 144.03 14.92 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.226 -0.443 . . . . 74.25 111.109 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.4 m -102.32 160.33 26.67 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.637 0.732 . . . . 42.02 110.873 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 126.38 13.26 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.652 2.235 . . . . 74.51 112.332 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.0 -0.21 31.64 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.737 -0.744 . . . . 74.53 112.508 179.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.409 ' O ' HG23 ' A' ' 5' ' ' VAL . 2.8 mm-40 -92.11 170.37 9.89 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.86 0.362 . . . . 74.5 110.86 -179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.6 m120 -116.26 130.06 56.6 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.172 -0.467 . . . . 74.3 110.852 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.763 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 3.1 mp -125.09 144.79 50.23 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.17 -0.468 . . . . 62.21 110.927 179.924 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -97.31 112.66 24.38 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.192 -0.458 . . . . 53.14 110.842 -179.879 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.611 ' HB ' HD12 ' A' ' 2' ' ' LEU . 58.8 mt -78.86 141.52 15.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.131 -0.486 . . . . 74.23 111.108 179.971 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 55.3 m -119.33 -48.81 2.4 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 73.24 110.861 179.959 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.422 ' HA ' HG22 ' A' ' 86' ' ' ILE . . . -146.09 172.68 13.06 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.215 -0.448 . . . . 74.54 111.084 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.513 ' O ' HG23 ' A' ' 89' ' ' VAL . 1.3 p80 -128.06 178.25 6.33 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.242 -0.435 . . . . 70.32 110.829 -179.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 40.2 t80 -138.77 99.88 3.91 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 75.15 110.933 -179.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 35.1 t70 54.26 26.35 6.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.135 -0.484 . . . . 60.21 110.839 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.593 ' HD2' HD12 ' A' ' 81' ' ' ILE . 38.4 m-85 63.08 25.37 14.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.204 -0.453 . . . . 73.22 110.933 -179.851 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.488 ' O ' HG23 ' A' ' 52' ' ' VAL . 14.7 mm-40 -114.11 -50.01 2.83 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 74.44 110.858 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.531 ' HB3' HD21 ' A' ' 49' ' ' LEU . 67.9 m95 -111.42 143.97 41.38 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.167 -0.47 . . . . 73.11 110.9 -179.943 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.679 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -119.69 133.5 55.6 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.229 -0.442 . . . . 74.33 110.918 -179.99 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.8 mm -88.79 95.23 5.21 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.158 -0.474 . . . . 72.31 111.145 179.987 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.763 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.6 142.7 42.08 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.205 -0.452 . . . . 75.33 111.105 179.87 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -114.52 153.63 46.65 Favored Pre-proline 0 C--N 1.329 -0.324 0 CA-C-O 121.558 0.694 . . . . 72.01 110.889 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.408 ' HD3' HD22 ' A' ' 18' ' ' LEU . 53.6 Cg_endo -69.79 105.89 1.57 Allowed 'Trans proline' 0 C--O 1.232 0.199 0 C-N-CA 122.683 2.255 . . . . 64.05 112.369 179.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 67.7 mt -68.52 -36.7 75.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.305 0 CA-C-N 116.242 -0.435 . . . . 73.43 111.107 179.976 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' A ASN . . . . . . . . . . . . . 40.9 m-80 -98.05 -59.93 1.66 Allowed 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.203 -0.453 . . . . 53.44 110.845 179.975 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' B ARG . . . . . . . . . . . . . 5.6 mmp_? -53.57 165.76 0.37 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 72.35 110.87 -179.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.415 HD23 ' HA ' ' A' ' 44' ' ' LEU . 12.4 mt -128.9 120.97 27.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.196 -0.457 . . . . 62.12 110.91 179.991 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 179.05 -41.53 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.273 0 C-N-CA 120.729 -0.748 . . . . 52.13 112.48 179.876 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 137.61 165.78 10.5 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.687 -0.768 . . . . 71.41 112.511 -179.881 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.76 144.99 55.77 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.665 2.244 . . . . 74.31 112.325 -179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -127.7 -137.1 4.39 Favored Glycine 0 N--CA 1.452 -0.281 0 C-N-CA 120.754 -0.736 . . . . 53.34 112.468 179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.531 HD21 ' HB3' ' A' ' 36' ' ' TRP . 1.2 tt -149.55 125.84 10.79 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.861 0.362 . . . . 54.43 110.908 -179.922 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 12.4 p -136.58 132.7 18.77 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.622 0.725 . . . . 62.23 111.096 179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.593 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.6 Cg_endo -69.78 151.53 68.97 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.707 2.272 . . . . 64.43 112.287 179.962 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.771 HG12 ' HB ' ' A' ' 71' ' ' THR . 14.2 t -62.9 -21.9 29.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.26 0 CA-C-N 116.232 -0.44 . . . . 72.41 111.155 179.892 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 4.1 m -78.4 -2.4 38.15 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.148 -0.478 . . . . 61.34 110.877 -179.86 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.4 m-85 -125.07 17.58 8.46 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.147 -0.479 . . . . 74.22 110.907 -179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.593 HG22 ' O ' ' A' ' 51' ' ' PRO . 5.2 m -153.56 153.1 9.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.14 -0.482 . . . . 73.14 111.127 179.843 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.53 ' HG2' HG23 ' A' ' 58' ' ' ILE . 18.5 ttm180 -123.75 119.84 30.92 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.151 -0.477 . . . . 71.21 110.915 -179.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 16.1 mm -67.19 113.81 3.49 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.203 -0.453 . . . . 75.55 111.168 179.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.53 HG23 ' HG2' ' A' ' 56' ' ' ARG . 1.2 pt -135.33 139.07 47.53 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.159 -0.473 . . . . 61.33 111.126 179.909 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 30.6 t0 -75.27 122.07 23.13 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 71.02 110.878 179.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.75 HD12 ' CZ ' ' A' ' 3' ' ' PHE . 0.6 OUTLIER -51.98 -31.7 30.42 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.213 -0.449 . . . . 73.44 110.876 -179.912 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 1.5 mpp? -85.56 -28.52 24.83 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.16 -0.473 . . . . 74.04 110.869 179.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -143.96 77.53 14.61 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-O 121.638 0.732 . . . . 63.24 110.896 179.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.737 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.6 Cg_endo -69.78 -8.17 22.92 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.675 2.25 . . . . 75.12 112.367 -179.973 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.91 -5.69 44.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.17 -0.468 . . . . 70.13 111.125 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 1.1 mtpt -84.04 -51.75 6.86 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.184 -0.462 . . . . 72.1 110.904 179.979 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.615 ' O ' HG12 ' A' ' 69' ' ' VAL . 12.2 m-85 -99.87 23.62 9.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.223 -0.444 . . . . 74.21 110.931 -179.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.737 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -83.37 -15.93 47.97 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.122 -0.49 . . . . 62.32 111.112 179.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 8.9 m -98.14 -18.74 18.32 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.211 -0.45 . . . . 74.44 110.894 -179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 1.026 HG21 HD11 ' A' ' 80' ' ' ILE . 9.3 p -51.14 150.22 0.86 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.092 -0.504 . . . . 74.1 111.129 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 30.8 m-20 -104.76 88.5 2.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.14 -0.482 . . . . 74.12 110.84 179.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.771 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -51.89 -43.22 63.22 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.219 -0.446 . . . . 63.33 111.089 -179.857 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 18.3 t80 -53.67 -43.89 69.23 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.282 -0.417 . . . . 74.1 110.92 -179.942 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.4 t0 -63.92 110.15 2.01 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.129 -0.487 . . . . 71.11 110.864 179.93 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.23 -26.33 28.03 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 72.01 110.857 -179.862 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -67.11 -56.07 11.54 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.21 -0.45 . . . . 71.01 110.893 -179.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 4.7 mt-30 -59.2 -56.65 19.41 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.145 -0.479 . . . . 73.34 110.902 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.414 HG21 HG11 ' A' ' 52' ' ' VAL . 2.8 p -52.48 -32.38 16.55 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.199 -0.455 . . . . 61.44 111.168 179.954 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 14.2 mtm -67.73 -55.0 14.82 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.148 -0.478 . . . . 64.21 110.879 179.933 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 53.5 mttt -54.34 -38.51 66.11 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.186 -0.461 . . . . 64.21 110.928 179.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 1.026 HD11 HG21 ' A' ' 69' ' ' VAL . 88.6 mt -66.05 -54.64 24.85 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.225 -0.443 . . . . 61.33 111.149 179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.75 HG23 ' HB ' ' A' ' 86' ' ' ILE . 95.1 mt -60.37 -33.88 55.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.175 -0.466 . . . . 64.41 111.163 179.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.0 t70 -71.07 -51.84 22.89 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.176 -0.466 . . . . 54.33 110.83 179.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 24.1 mm-40 -60.49 -43.09 97.39 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.188 -0.46 . . . . 72.21 110.915 -179.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.7 m-85 -76.13 -17.78 59.44 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.142 -0.481 . . . . 74.42 110.847 -179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 33.5 mmtm 61.36 52.53 3.77 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.178 -0.464 . . . . 50.31 110.891 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.75 ' HB ' HG23 ' A' ' 81' ' ' ILE . 21.2 mt -78.4 131.09 69.59 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.639 0.733 . . . . 72.34 111.116 179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.407 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 53.9 Cg_endo -69.74 158.87 55.5 Favored 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.753 2.302 . . . . 74.42 112.297 179.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -87.41 163.25 16.86 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.183 -0.462 . . . . 63.41 111.147 -179.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.513 HG23 ' O ' ' A' ' 31' ' ' HIS . 96.2 t -51.01 -58.02 2.29 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.221 -0.445 . . . . 70.31 111.169 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -50.85 -46.8 60.31 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.194 -0.457 . . . . 62.43 110.873 -179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.6 mp0 -59.4 -42.2 91.17 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.151 -0.477 . . . . 55.21 110.915 -179.905 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 12.2 t90 -64.96 -41.55 95.37 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.195 -0.457 . . . . 62.35 110.912 -179.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.3 mmtp -62.6 -44.67 95.73 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.248 -0.433 . . . . 45.11 110.903 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -64.3 -46.67 82.57 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.258 -0.428 . . . . 73.2 110.873 179.833 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -57.73 -53.72 55.02 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.223 -0.444 . . . . 72.53 110.927 -179.901 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 4.6 p -61.04 -46.68 89.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.204 -0.453 . . . . 74.13 111.081 -179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 19.7 mmm-85 -51.97 -53.88 36.27 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.25 -0.432 . . . . 75.43 110.867 -179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 34.0 mtp180 -65.98 -32.85 74.57 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.191 -0.459 . . . . 74.14 110.888 -179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 66.7 t80 -64.98 -41.05 95.78 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.155 -0.475 . . . . 72.3 110.916 -179.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 35.5 mttp -74.61 -25.17 59.07 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.133 -0.485 . . . . 74.42 110.914 179.91 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 22.7 mt-10 -93.38 -175.14 3.72 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.179 -0.464 . . . . 74.14 110.898 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 44.4 m -70.19 120.93 16.61 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.187 -0.461 . . . . 73.25 110.812 -179.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 13.8 m -72.31 175.03 6.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.108 -0.496 . . . . 72.42 110.89 -179.864 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 3.3 mt -70.41 139.03 20.76 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.135 -0.484 . . . . 54.43 111.159 179.929 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.8 pt20 179.0 167.71 0.94 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.22 -0.445 . . . . 73.41 110.887 179.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.486 HD13 ' H ' ' A' ' 106' ' ' ILE . 0.1 OUTLIER -142.24 173.96 6.68 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.196 -0.456 . . . . 70.2 111.141 -179.995 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 159.49 116.25 0.43 Allowed Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.778 -0.725 . . . . 63.02 112.499 179.914 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 26.4 t-20 -68.56 132.29 46.68 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.859 0.362 . . . . 72.2 110.89 -179.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 176.96 -95.19 0.1 Allowed Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.77 -0.729 . . . . 65.11 112.487 179.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 22.5 m-70 -91.38 102.92 15.61 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-O 120.843 0.354 . . . . 70.51 110.825 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 86.16 150.5 15.73 Favored Glycine 0 N--CA 1.45 -0.376 0 C-N-CA 120.75 -0.738 . . . . 72.12 112.527 -179.958 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.4 mp0 -86.5 104.03 15.58 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.812 0.339 . . . . 75.52 110.911 -179.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.4 m -88.01 -177.56 5.78 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.197 -0.456 . . . . 51.22 110.849 -179.795 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -109.57 138.26 46.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.118 -0.492 . . . . 75.13 110.917 -179.992 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -148.16 117.52 0.9 Allowed Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.77 -0.728 . . . . 61.34 112.484 180.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -151.75 170.34 19.99 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.792 0.33 . . . . 75.32 110.915 -179.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.227 -0.442 . . . . 74.31 110.898 179.934 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' -9' ' ' GLY . . . . . 0.552 ' HA3' HD11 ' B' ' -6' ' ' ILE . . . . . . . . 0 N--CA 1.451 -0.306 0 N-CA-C 112.487 -0.245 . . . . 72.53 112.487 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 25.8 mtmm -122.48 -47.83 2.09 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.809 0.337 . . . . 72.34 110.892 -179.939 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' -7' ' ' PHE . . . . . 0.467 ' HD2' HD12 ' A' ' 49' ' ' LEU . 9.3 m-85 -80.21 -72.0 0.43 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.221 -0.445 . . . . 74.05 110.865 -179.984 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' -6' ' ' ILE . . . . . 0.552 HD11 ' HA3' ' B' ' -9' ' ' GLY . 22.2 mm 51.94 77.6 0.45 Allowed Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.596 0.713 . . . . 64.35 111.106 179.945 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 92.64 0.51 Allowed 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.712 2.275 . . . . 70.51 112.324 179.863 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -96.09 28.53 3.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.269 -0.423 . . . . 64.21 110.884 -179.875 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' -3' ' ' ARG . . . . . 0.486 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 0.5 OUTLIER -89.64 159.09 44.43 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.58 0.705 . . . . 71.34 110.883 -179.966 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' -2' ' ' PRO . . . . . 0.486 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 54.1 Cg_endo -69.78 112.41 3.08 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.669 2.246 . . . . 74.34 112.356 179.964 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' -1' ' ' ALA . . . . . 0.429 ' HA ' ' HD2' ' B' ' 0' ' ' PRO . . . -51.22 108.99 1.18 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.641 0.734 . . . . 64.44 111.087 179.886 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 0' ' ' PRO . . . . . 0.429 ' HD2' ' HA ' ' B' ' -1' ' ' ALA . 53.9 Cg_endo -69.8 147.14 61.98 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.647 2.231 . . . . 61.42 112.373 179.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 60.5 mttt -97.6 160.77 27.88 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.592 0.711 . . . . 73.41 110.868 179.966 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 167.85 23.28 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.654 2.236 . . . . 71.45 112.372 179.872 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 112.57 3.11 Favored 'Trans proline' 0 C--O 1.231 0.163 0 C-N-CA 122.666 2.244 . . . . 75.03 112.372 179.992 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 85.7 p -145.31 173.19 12.18 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.221 -0.445 . . . . 75.53 110.897 -179.829 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 5.9 p -119.21 103.88 9.92 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.134 -0.485 . . . . 62.43 110.856 -179.793 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.135 -0.484 . . . . 62.41 111.084 179.902 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.751 0.31 . . . . 75.35 110.925 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . 0.589 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -120.4 160.34 44.19 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.585 0.707 . . . . 64.41 111.113 179.909 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.589 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.9 Cg_endo -69.73 122.4 9.09 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.702 2.268 . . . . 71.31 112.314 -179.952 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.675 HD12 HD12 ' A' ' 28' ' ' ILE . 0.8 OUTLIER -120.14 147.19 45.2 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.248 -0.433 . . . . 75.41 110.962 179.935 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 14.8 m-85 -124.48 143.14 50.82 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.196 -0.456 . . . . 73.43 110.849 179.992 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.913 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -120.88 151.98 39.0 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.168 -0.469 . . . . 73.41 111.088 179.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.495 HG13 ' HB3' ' A' ' 56' ' ' ARG . 6.2 p -120.17 122.19 67.72 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.27 0 CA-C-N 116.196 -0.457 . . . . 64.14 111.112 179.976 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.718 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -60.24 144.53 50.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.137 -0.483 . . . . 52.05 111.118 -179.942 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.656 HD11 ' HB2' ' A' ' 56' ' ' ARG . 23.3 mt -117.48 -12.17 10.43 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.22 -0.445 . . . . 64.42 110.873 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 64.7 m-85 -134.67 164.75 26.81 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.238 -0.437 . . . . 65.02 110.94 179.971 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.3 tp10 -89.97 105.27 17.7 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.133 -0.485 . . . . 75.31 110.859 -179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -87.3 123.47 32.31 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.149 -0.478 . . . . 71.4 110.861 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -100.84 96.88 7.58 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.176 -0.466 . . . . 74.41 110.905 179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.13 157.69 1.75 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.245 -0.434 . . . . 62.25 111.118 179.805 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -116.26 -30.6 5.9 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.21 -0.45 . . . . 72.24 110.876 -179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.5 mmm180 -136.2 -177.11 4.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.166 -0.47 . . . . 74.32 110.869 -179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 75.3 m-20 -60.39 -41.2 93.34 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.156 -0.475 . . . . 64.44 110.873 179.98 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -56.93 -39.85 75.28 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.145 -0.479 . . . . 73.04 110.864 -179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 9.0 mt-10 -79.87 143.03 34.67 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.206 -0.452 . . . . 64.31 110.913 -179.937 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.8 tp -119.89 127.8 53.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.145 -0.479 . . . . 53.01 110.869 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -72.94 139.77 46.99 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.209 -0.451 . . . . 65.44 110.852 179.845 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.718 ' CG1' HG21 ' A' ' 6' ' ' THR . 11.2 p -147.14 151.75 13.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.178 -0.465 . . . . 72.21 111.134 -180.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.5 m -110.23 159.91 30.27 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.657 0.741 . . . . 73.14 110.853 -179.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 120.15 6.98 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.644 2.229 . . . . 71.22 112.357 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.08 3.64 31.46 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.76 -0.733 . . . . 53.13 112.496 179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -91.97 149.47 21.53 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.881 0.372 . . . . 64.23 110.88 -179.856 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.604 ' CB ' HD12 ' A' ' 42' ' ' ILE . 6.8 m120 -93.79 139.86 30.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.157 -0.474 . . . . 75.41 110.926 -179.934 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.724 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 4.4 mp -141.23 145.4 35.55 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.188 -0.46 . . . . 73.42 110.903 179.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -99.1 113.9 26.36 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.224 -0.444 . . . . 62.42 110.877 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.913 HD11 ' HB2' ' A' ' 4' ' ' ALA . 43.5 mt -77.22 149.76 6.08 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.153 -0.476 . . . . 73.14 111.138 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 21.3 m -123.55 -35.91 2.85 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 71.33 110.863 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -166.52 173.62 9.65 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.182 -0.463 . . . . 63.22 111.085 -179.998 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.479 ' ND1' HD13 ' A' ' 81' ' ' ILE . 1.6 p80 -124.11 176.28 6.48 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 71.23 110.848 -179.968 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 42.6 t80 -137.76 99.56 3.95 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.221 -0.445 . . . . 75.42 110.887 -179.874 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 32.3 t70 55.07 24.92 6.48 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.105 -0.498 . . . . 74.5 110.895 179.892 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.581 ' HD2' HD12 ' A' ' 81' ' ' ILE . 35.0 m-85 64.08 15.69 9.45 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 63.54 110.95 -179.768 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.505 ' O ' HG23 ' A' ' 52' ' ' VAL . 28.1 mm-40 -103.34 -50.65 3.41 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.125 -0.489 . . . . 72.55 110.858 -179.958 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 83.0 m95 -111.5 162.86 14.66 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.146 -0.479 . . . . 75.24 110.964 179.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.635 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.4 OUTLIER -135.93 146.24 47.1 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.263 -0.426 . . . . 73.51 110.896 -179.954 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 11.6 mm -104.12 95.23 3.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.142 -0.481 . . . . 64.22 111.122 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.724 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -116.42 145.07 43.53 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.15 -0.477 . . . . 60.41 111.075 179.826 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.0 ptpp? -116.14 157.46 45.12 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.59 0.709 . . . . 74.34 110.872 179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 131.5 21.46 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.713 2.276 . . . . 35.53 112.339 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.604 HD12 ' CB ' ' A' ' 25' ' ' ASN . 40.5 mt -91.04 -44.17 14.48 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.352 0 CA-C-N 116.213 -0.449 . . . . 73.3 111.116 179.929 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' A ASN . . . . . . . . . . . . . 32.8 t30 -53.35 -73.84 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.126 -0.488 . . . . 63.33 110.914 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' B ARG . . . . . . . . . . . . . 9.3 ptm180 -93.24 -179.83 5.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.13 -0.486 . . . . 62.35 110.849 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 11.0 mp -84.9 -74.75 0.38 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.14 -0.482 . . . . 72.13 110.876 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 52.78 -108.18 0.67 Allowed Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.722 -0.751 . . . . 71.12 112.469 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -179.97 165.22 33.53 Favored Glycine 0 N--CA 1.453 -0.229 0 C-N-CA 120.702 -0.761 . . . . 64.55 112.458 -179.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 131.73 21.86 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.685 2.257 . . . . 35.34 112.323 -179.952 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -119.57 -153.52 9.3 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.766 -0.73 . . . . 40.01 112.52 179.965 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -130.32 129.33 43.06 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-O 120.856 0.36 . . . . 75.23 110.91 -179.918 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.5 p -141.15 132.04 13.42 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.668 0.746 . . . . 71.15 111.098 179.868 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.74 165.51 30.69 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.662 2.241 . . . . 72.42 112.363 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.729 HG12 ' HB ' ' A' ' 71' ' ' THR . 15.3 t -74.1 -21.24 17.77 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.24 -0.437 . . . . 61.42 111.154 179.876 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 56.4 m -81.3 1.8 30.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.17 -0.468 . . . . 75.44 110.832 -179.825 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.559 ' O ' HG22 ' A' ' 6' ' ' THR . 13.9 m-85 -129.26 22.75 5.61 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.134 -0.485 . . . . 75.54 110.911 -179.892 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 27.5 m -151.3 146.41 16.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.286 0 CA-C-N 116.131 -0.486 . . . . 75.11 111.096 179.905 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.656 ' HB2' HD11 ' A' ' 7' ' ' LEU . 33.3 ttp85 -115.64 111.66 20.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.137 -0.483 . . . . 65.54 110.912 -179.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.4 mm -66.05 118.55 9.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.207 -0.451 . . . . 65.14 111.074 -179.989 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.459 HG23 ' HG2' ' A' ' 56' ' ' ARG . 15.3 pt -136.1 165.89 28.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.147 -0.479 . . . . 62.41 111.147 179.815 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -109.21 127.31 54.12 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.138 -0.483 . . . . 70.32 110.867 179.865 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 5.9 mt -55.48 -29.59 59.04 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 71.32 110.889 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.58 -20.19 28.29 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 74.03 110.935 179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.5 t0 -161.45 82.1 1.93 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.648 0.737 . . . . 75.44 110.819 179.939 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.737 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.7 Cg_endo -69.75 -8.52 23.81 Favored 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.717 2.278 . . . . 72.34 112.351 -179.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.79 0.25 56.2 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.212 -0.449 . . . . 75.1 111.109 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -84.31 -47.15 11.04 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.197 -0.456 . . . . 74.42 110.889 179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.55 ' O ' HG12 ' A' ' 69' ' ' VAL . 19.0 m-85 -110.98 23.71 13.81 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.2 -0.454 . . . . 74.42 110.914 -179.927 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.737 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -78.07 -20.82 51.57 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 72.21 111.077 179.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 80.9 p -104.59 -8.42 18.99 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.257 -0.428 . . . . 71.23 110.846 -179.774 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.949 HG21 HD11 ' A' ' 80' ' ' ILE . 9.8 p -51.37 157.84 0.38 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.161 -0.472 . . . . 70.52 111.123 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 65.4 m-20 -104.09 82.46 1.97 Allowed 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.138 -0.483 . . . . 71.45 110.871 179.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.729 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -54.29 -44.64 72.11 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.213 -0.448 . . . . 63.41 111.093 -179.877 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 47.4 t80 -55.28 -40.92 71.58 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.239 -0.437 . . . . 63.11 110.948 -179.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -63.96 108.42 1.49 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.103 -0.499 . . . . 73.23 110.852 179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . 0.404 ' HA ' HG12 ' A' ' 77' ' ' VAL . 0.2 OUTLIER -51.97 -29.3 19.99 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.2 -0.455 . . . . 61.22 110.876 -179.908 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 12.9 mt-10 -66.98 -56.42 10.23 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.229 -0.441 . . . . 73.4 110.869 -179.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.1 mt-30 -59.23 -54.9 41.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.461 . . . . 70.23 110.936 -179.944 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.52 ' HA ' HD12 ' A' ' 80' ' ' ILE . 4.8 p -54.27 -32.68 24.15 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.153 -0.476 . . . . 74.24 111.121 179.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.4 mtm -67.37 -56.04 11.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.156 -0.474 . . . . 73.32 110.817 179.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 37.1 mttt -54.62 -37.51 65.71 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.247 -0.433 . . . . 64.43 110.911 179.962 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.949 HD11 HG21 ' A' ' 69' ' ' VAL . 27.9 mt -66.22 -55.1 20.4 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.226 -0.443 . . . . 70.31 111.14 179.864 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.72 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.4 mt -60.51 -36.73 71.78 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.153 -0.476 . . . . 70.43 111.149 179.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.6 t70 -70.93 -46.73 61.96 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.156 -0.475 . . . . 75.33 110.857 179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -64.42 -47.1 80.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.233 -0.44 . . . . 75.32 110.853 -179.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -72.34 -12.84 61.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.14 -0.482 . . . . 73.21 110.898 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.56 53.06 6.38 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.137 -0.483 . . . . 72.14 110.881 179.98 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.72 ' HB ' HG23 ' A' ' 81' ' ' ILE . 59.0 mt -83.73 132.94 47.44 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.64 0.733 . . . . 75.41 111.105 179.871 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.418 ' HD2' HG23 ' A' ' 86' ' ' ILE . 53.5 Cg_endo -69.76 163.83 36.81 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.705 2.27 . . . . 71.14 112.324 179.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -98.28 169.2 9.74 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.173 -0.467 . . . . 72.02 111.135 -179.954 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 91.7 t -51.43 -56.53 5.07 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.214 -0.448 . . . . 71.51 111.131 179.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.4 mt-10 -52.43 -52.13 55.57 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.475 . . . . 63.12 110.857 -179.993 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 57.7 mm-40 -56.86 -42.68 80.19 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.148 -0.478 . . . . 55.14 110.886 -179.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.45 ' O ' HG23 ' A' ' 96' ' ' THR . 33.4 t90 -66.1 -36.93 84.48 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.218 -0.446 . . . . 75.21 110.898 -179.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 3.1 mmpt? -68.43 -35.03 77.02 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.214 -0.448 . . . . 74.42 110.892 179.936 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 17.9 t0 -72.16 -49.46 35.62 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.259 -0.428 . . . . 63.14 110.834 179.914 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.4 ' HG2' ' HA ' ' A' ' 92' ' ' TRP . 21.0 pt20 -61.56 -39.94 92.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.196 -0.456 . . . . 71.54 110.905 -179.914 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.45 HG23 ' O ' ' A' ' 92' ' ' TRP . 38.1 p -70.57 -44.53 67.19 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 73.24 111.153 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 2.1 mmp_? -59.17 -44.71 92.15 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 75.4 110.902 179.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 8.1 ptp180 -74.26 -34.11 63.5 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.173 -0.467 . . . . 62.52 110.898 -179.938 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 13.9 t80 -69.18 -29.6 67.62 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.136 -0.484 . . . . 74.02 110.966 -179.875 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 5.4 mtpt -90.88 -17.45 26.46 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.101 -0.499 . . . . 71.32 110.877 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -57.01 179.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.251 -0.431 . . . . 52.15 110.933 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.4 m -81.58 -176.52 6.09 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.455 . . . . 72.21 110.857 -179.8 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 4.1 m 59.74 36.93 22.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.122 -0.49 . . . . 54.22 110.914 -179.757 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 20.2 mm -113.36 148.5 16.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.111 -0.495 . . . . 74.33 111.163 179.934 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -169.0 129.62 1.13 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.168 -0.469 . . . . 74.13 110.877 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.2 mp -132.24 151.64 35.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.208 -0.451 . . . . 34.51 111.13 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -80.46 56.68 4.7 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.681 -0.771 . . . . 75.33 112.51 179.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 27.2 p-10 -120.05 150.01 41.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.856 0.36 . . . . 55.54 110.934 -179.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -93.5 58.58 2.26 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.745 -0.741 . . . . 41.41 112.523 179.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 18.5 t-80 -175.08 140.45 0.52 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-O 120.866 0.365 . . . . 70.41 110.868 -179.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 167.48 142.96 3.62 Favored Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.755 -0.736 . . . . 74.02 112.48 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 6.0 pt20 -168.63 146.26 3.97 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.784 0.325 . . . . 73.41 110.942 -179.906 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 2.8 p -108.86 174.84 5.69 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.223 -0.444 . . . . 73.54 110.894 -179.844 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 32.5 mm-40 -146.85 179.62 7.46 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.149 -0.478 . . . . 65.14 110.893 -179.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -175.12 121.96 0.85 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.722 -0.751 . . . . 73.55 112.479 -179.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 2.3 mp -127.06 -67.86 0.83 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.773 0.32 . . . . 61.33 110.942 -179.941 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 . . . . . 0 C--N 1.329 -0.31 0 CA-C-N 116.156 -0.474 . . . . 71.1 110.878 179.95 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.328 0 N-CA-C 112.525 -0.23 . . . . 53.23 112.525 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 4.1 pttp -133.24 -43.29 0.86 Allowed 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.805 0.336 . . . . 73.54 110.907 -179.97 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 -55.43 -74.81 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.25 -0.432 . . . . 75.11 110.868 179.942 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.0 mm 51.83 81.0 0.27 Allowed Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.607 0.718 . . . . 64.35 111.092 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 81.43 0.82 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.671 2.247 . . . . 73.33 112.309 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 5.4 t -97.21 37.27 1.35 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.187 -0.46 . . . . 72.1 110.861 -179.886 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' -3' ' ' ARG . . . . . 0.446 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 5.6 mmm180 -98.16 160.56 27.98 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.596 0.713 . . . . 54.45 110.879 -179.953 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' -2' ' ' PRO . . . . . 0.446 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.6 Cg_endo -69.79 99.53 0.76 Allowed 'Trans proline' 0 C--N 1.34 0.13 0 C-N-CA 122.657 2.238 . . . . 74.44 112.31 -179.979 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -51.13 108.96 1.17 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.542 0.687 . . . . 62.44 111.094 179.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 154.25 67.98 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.704 2.269 . . . . 74.51 112.334 -179.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 12.7 mtpp -99.56 160.66 26.83 Favored Pre-proline 0 C--N 1.328 -0.347 0 CA-C-O 121.539 0.685 . . . . 73.24 110.87 179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 167.82 23.32 Favored 'Trans proline' 0 C--O 1.231 0.158 0 C-N-CA 122.693 2.262 . . . . 62.12 112.335 179.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 -42.76 3.15 Favored 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.683 2.255 . . . . 62.32 112.359 179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 3.4 m -79.73 59.34 3.05 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.186 -0.461 . . . . 63.03 110.866 -179.863 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 85.5 p -91.3 -56.96 2.94 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.205 -0.452 . . . . 73.54 110.877 -179.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 34.34 111.1 179.897 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.812 0.339 . . . . 63.15 110.852 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . 0.589 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -74.17 160.51 81.38 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.534 0.683 . . . . 75.24 111.092 179.939 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.589 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.5 Cg_endo -69.8 172.81 11.99 Favored 'Trans proline' 0 C--O 1.232 0.191 0 C-N-CA 122.69 2.26 . . . . 75.02 112.327 -179.989 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.777 HD12 HD13 ' A' ' 86' ' ' ILE . 0.1 OUTLIER -155.02 120.43 5.0 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.199 -0.455 . . . . 53.13 110.923 179.944 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.463 ' CE2' HD12 ' A' ' 60' ' ' LEU . 97.1 m-85 -128.55 139.55 52.24 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.176 -0.466 . . . . 61.45 110.866 179.966 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.477 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -133.93 159.55 40.37 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.123 -0.49 . . . . 34.32 111.111 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.6 p -124.75 127.05 72.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.228 -0.442 . . . . 70.42 111.11 -179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.665 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -67.04 126.95 30.77 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.209 -0.451 . . . . 53.3 111.106 -179.977 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.553 HD11 ' HB2' ' A' ' 56' ' ' ARG . 66.1 mt -101.73 -17.68 16.16 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.204 -0.453 . . . . 50.32 110.906 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 31.1 m-85 -132.87 160.82 35.87 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.15 -0.477 . . . . 72.3 110.889 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -86.42 105.08 16.48 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.084 -0.507 . . . . 72.33 110.852 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 11.5 t80 -84.81 126.17 33.22 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 65.11 110.894 -179.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 7.4 mttm -101.91 100.17 10.45 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.119 -0.491 . . . . 70.32 110.905 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.74 149.68 5.94 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.227 -0.442 . . . . 70.3 111.091 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -123.05 -36.34 2.87 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.243 -0.435 . . . . 73.02 110.884 -179.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.9 mmt180 -114.56 -178.19 3.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.173 -0.467 . . . . 75.14 110.861 -179.914 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -68.36 -35.68 78.09 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.138 -0.483 . . . . 71.23 110.865 179.978 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -67.96 -41.17 82.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.242 -0.436 . . . . 61.25 110.858 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 6.0 mm-40 -61.15 166.77 3.44 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.202 -0.454 . . . . 63.02 110.904 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.2 tp -142.37 149.96 40.07 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.145 -0.48 . . . . 44.44 110.948 -179.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 8.0 p-10 -94.67 131.46 40.44 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.196 -0.456 . . . . 71.53 110.867 179.862 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.665 ' CG1' HG21 ' A' ' 6' ' ' THR . 14.8 p -148.59 149.49 15.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.23 -0.441 . . . . 72.44 111.101 -179.95 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.9 m -110.67 160.43 28.7 Favored Pre-proline 0 C--N 1.33 -0.258 0 CA-C-O 121.646 0.736 . . . . 74.44 110.859 -179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 128.2 15.67 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.71 2.273 . . . . 72.22 112.334 179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.09 -6.02 32.28 Favored Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.709 -0.758 . . . . 54.12 112.509 179.991 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 59.9 mm-40 -92.2 155.18 18.18 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.852 0.358 . . . . 51.53 110.871 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.69 ' C ' HD22 ' A' ' 26' ' ' LEU . 7.1 m120 -96.14 139.25 32.57 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 74.03 110.917 -179.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.69 HD22 ' C ' ' A' ' 25' ' ' ASN . 3.5 mm? -131.57 142.01 49.81 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.18 -0.464 . . . . 72.13 110.886 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -100.82 116.78 33.5 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.209 -0.45 . . . . 44.13 110.842 -179.93 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.599 ' HB ' HD13 ' A' ' 2' ' ' LEU . 26.4 mt -84.08 146.01 7.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.106 -0.497 . . . . 72.21 111.115 179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 22.9 m -118.53 -27.76 5.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.175 -0.466 . . . . 65.15 110.828 179.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.44 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -169.67 178.48 4.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.209 -0.45 . . . . 65.53 111.128 -179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.469 ' ND1' HD13 ' A' ' 81' ' ' ILE . 1.6 p80 -129.47 176.59 7.85 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.254 -0.43 . . . . 72.32 110.862 -179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.9 t80 -137.89 99.4 3.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.199 -0.455 . . . . 74.1 110.857 -179.84 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 46.6 t0 54.31 25.69 6.17 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.146 -0.479 . . . . 72.45 110.831 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.603 ' HD2' HD12 ' A' ' 81' ' ' ILE . 25.6 m-85 63.26 23.1 13.66 Favored 'General case' 0 C--N 1.327 -0.37 0 CA-C-N 116.194 -0.457 . . . . 62.14 110.958 -179.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.49 ' O ' HG23 ' A' ' 52' ' ' VAL . 21.9 mm-40 -111.79 -53.3 2.72 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.088 -0.505 . . . . 73.33 110.899 179.99 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 79.9 m95 -109.13 144.26 37.41 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.152 -0.477 . . . . 74.55 110.929 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.79 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.4 OUTLIER -117.59 130.09 56.18 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.244 -0.435 . . . . 75.15 110.873 -179.965 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 20.1 mm -87.9 95.11 4.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.119 -0.491 . . . . 65.11 111.153 179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.683 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.09 157.75 19.02 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 60.13 111.066 179.854 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.8 pttp -132.33 157.94 76.93 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.558 0.694 . . . . 72.23 110.872 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 115.15 3.95 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.679 2.253 . . . . 75.23 112.324 179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 68.8 mt -79.36 -44.59 23.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.167 -0.469 . . . . 75.41 111.145 179.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' A ASN . . . . . . . . . . . . . 5.1 m-20 -52.97 -64.02 0.95 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.214 -0.448 . . . . 70.15 110.908 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' B ARG . . . . . . . . . . . . . 0.3 OUTLIER -103.97 169.87 8.25 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.198 -0.455 . . . . 65.51 110.831 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 56.2 mt -74.29 -73.03 0.25 Allowed 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.161 -0.472 . . . . 74.31 110.911 -180.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 52.64 -111.39 1.6 Allowed Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.709 -0.758 . . . . 34.32 112.452 179.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -174.33 165.88 37.59 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.757 -0.735 . . . . 65.01 112.507 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 139.5 40.43 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.703 2.268 . . . . 71.25 112.353 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -128.17 -144.97 5.96 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.746 -0.74 . . . . 13.13 112.514 179.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -147.98 129.87 15.27 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-O 120.869 0.366 . . . . 71.21 110.867 -179.899 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 11.0 p -142.36 132.83 12.59 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.634 0.731 . . . . 72.14 111.101 179.831 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.572 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.6 Cg_endo -69.78 152.27 69.18 Favored 'Trans proline' 0 C--O 1.231 0.162 0 C-N-CA 122.656 2.238 . . . . 74.15 112.355 179.934 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.79 HG22 ' CD2' ' A' ' 37' ' ' PHE . 13.7 t -62.52 -22.31 29.44 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.225 -0.443 . . . . 72.22 111.146 179.958 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 36.9 t -78.04 -3.18 40.84 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.144 -0.48 . . . . 72.35 110.889 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.6 m-85 -123.57 18.05 9.62 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.129 -0.487 . . . . 64.35 110.938 -179.898 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.572 HG22 ' O ' ' A' ' 51' ' ' PRO . 3.8 m -153.95 149.41 12.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.289 0 CA-C-N 116.093 -0.503 . . . . 72.33 111.142 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.553 ' HB2' HD11 ' A' ' 7' ' ' LEU . 21.4 ttm180 -116.41 118.12 31.83 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.165 -0.47 . . . . 72.22 110.897 -179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.598 HG23 HD21 ' A' ' 2' ' ' LEU . 24.3 mm -70.12 116.47 11.34 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.162 -0.472 . . . . 44.32 111.132 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.534 HG23 ' HG2' ' A' ' 56' ' ' ARG . 11.3 pt -134.71 172.02 16.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.145 -0.479 . . . . 61.41 111.122 179.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 26.8 t0 -115.06 147.17 40.5 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 116.171 -0.468 . . . . 55.24 110.85 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.463 HD12 ' CE2' ' A' ' 3' ' ' PHE . 13.2 mt -72.59 -35.54 67.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.2 -0.455 . . . . 71.55 110.932 -179.965 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 21.1 mmt -81.93 -25.21 35.09 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.142 -0.481 . . . . 70.43 110.865 179.857 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 9.7 t0 -151.94 74.13 7.77 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.605 0.717 . . . . 73.1 110.88 179.959 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.63 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.8 Cg_endo -69.71 -8.62 24.07 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.662 2.241 . . . . 75.24 112.381 -179.997 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -93.73 -14.77 25.92 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.195 -0.457 . . . . 42.21 111.071 179.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 18.7 ttmt -75.01 -51.96 12.28 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.273 -0.421 . . . . 75.34 110.913 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.617 ' O ' HG12 ' A' ' 69' ' ' VAL . 83.8 m-85 -95.4 23.02 6.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.186 -0.461 . . . . 74.23 110.908 -179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.63 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -87.57 -21.17 25.54 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.118 -0.492 . . . . 72.14 111.113 179.84 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.6 t -95.37 -21.12 18.58 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.233 -0.439 . . . . 72.54 110.865 -179.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.874 HG21 HD11 ' A' ' 80' ' ' ILE . 10.7 p -51.57 149.22 1.11 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.279 0 CA-C-N 116.116 -0.493 . . . . 72.34 111.133 179.955 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -99.32 105.77 17.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 73.13 110.835 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.741 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -68.37 -39.72 81.68 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.146 -0.479 . . . . 71.23 111.115 -179.874 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 35.2 t80 -54.05 -44.31 70.94 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.242 -0.435 . . . . 74.35 110.922 -179.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -63.99 108.94 1.63 Allowed 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.131 -0.486 . . . . 72.34 110.854 179.92 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -55.6 -25.18 37.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 74.12 110.839 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -66.48 -54.75 20.48 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.185 -0.462 . . . . 74.32 110.948 -179.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 3.8 mm100 -59.27 -57.09 14.54 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.079 -0.509 . . . . 64.35 110.943 179.999 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -52.66 -31.56 16.22 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 70.04 111.132 179.946 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.9 mtm -68.25 -54.31 18.52 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.135 -0.484 . . . . 62.25 110.849 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.0 mttm -55.69 -39.95 71.68 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.253 -0.43 . . . . 75.21 110.857 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.874 HD11 HG21 ' A' ' 69' ' ' VAL . 67.4 mt -64.93 -54.36 30.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.261 -0.427 . . . . 53.2 111.108 179.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.669 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.9 mt -59.98 -29.65 43.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.186 -0.461 . . . . 74.22 111.128 179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 16.8 t70 -70.76 -52.7 19.04 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.172 -0.467 . . . . 75.43 110.855 179.853 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -67.01 -31.37 71.87 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.229 -0.441 . . . . 72.42 110.898 -179.949 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 4.2 m-85 -81.32 -6.48 58.94 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.156 -0.475 . . . . 71.35 110.852 -179.911 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 50.7 42.81 27.74 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.163 -0.471 . . . . 41.35 110.923 179.972 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.777 HD13 HD12 ' A' ' 2' ' ' LEU . 3.8 mt -81.01 119.06 74.95 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.665 0.745 . . . . 75.32 111.091 179.91 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.44 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 53.8 Cg_endo -69.77 155.8 64.97 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.699 2.266 . . . . 64.15 112.336 179.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -80.19 176.97 9.28 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.224 -0.444 . . . . 55.43 111.129 -179.963 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.8 t -57.67 -53.02 50.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.221 -0.445 . . . . 72.23 111.099 179.955 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 29.0 mt-10 -51.63 -49.19 62.72 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.21 -0.45 . . . . 61.33 110.887 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 67.6 mm-40 -58.82 -41.13 86.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.169 -0.469 . . . . 71.35 110.892 -179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 30.0 t90 -64.68 -42.61 95.23 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.195 -0.457 . . . . 71.43 110.911 -179.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 4.6 mmpt? -61.98 -50.42 72.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.209 -0.451 . . . . 75.21 110.915 179.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -61.43 -41.35 97.05 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 75.21 110.86 179.868 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -59.88 -51.07 71.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 74.41 110.855 -179.877 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.1 p -64.32 -45.94 85.69 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.24 -0.436 . . . . 70.44 111.13 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 1.8 mmp_? -53.3 -53.02 57.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 74.31 110.936 179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 51.9 mtt180 -67.42 -34.69 77.74 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 73.43 110.843 -179.893 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 76.0 t80 -62.97 -38.44 91.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.175 -0.466 . . . . 75.51 110.913 -179.834 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 5.4 mtpp -74.9 -25.71 59.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.131 -0.486 . . . . 71.43 110.879 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 29.8 mm-40 -89.18 175.1 7.5 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.227 -0.442 . . . . 72.23 110.911 179.956 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.8 t 53.92 40.07 31.16 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.188 -0.46 . . . . 62.32 110.851 -179.799 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 15.5 m -79.94 -170.74 2.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.113 -0.494 . . . . 74.52 110.844 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 43.0 mm -51.48 -70.64 0.09 OUTLIER 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.15 -0.477 . . . . 73.21 111.143 179.987 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -53.39 163.22 0.63 Allowed 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.127 -0.488 . . . . 65.33 110.904 179.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 3.0 mt -118.47 132.08 69.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.168 -0.469 . . . . 63.41 111.1 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -114.26 -91.64 1.85 Allowed Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.698 -0.763 . . . . 40.41 112.474 179.942 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -119.16 134.23 55.32 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-O 120.829 0.347 . . . . 74.54 110.912 -179.894 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 99.85 -141.12 15.31 Favored Glycine 0 N--CA 1.452 -0.275 0 C-N-CA 120.746 -0.74 . . . . 64.53 112.48 179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 57.1 m80 -60.25 -176.87 0.05 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.884 0.373 . . . . 70.45 110.87 -179.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -139.93 -86.12 0.12 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.777 -0.725 . . . . 75.14 112.526 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 21.1 mp0 -53.98 123.31 12.2 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-O 120.859 0.361 . . . . 74.42 110.939 -179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 66.7 m -144.84 153.72 41.9 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.233 -0.44 . . . . 73.01 110.832 -179.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 9.4 tp-100 -54.33 126.8 24.63 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.108 -0.496 . . . . 70.34 110.91 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -86.28 103.48 2.8 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.748 -0.739 . . . . 35.43 112.497 -179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.613 HD12 ' N ' ' A' ' 117' ' ' GLU . 0.5 OUTLIER -115.77 -21.8 9.44 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.782 0.325 . . . . 50.45 110.915 -179.953 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.613 ' N ' HD12 ' A' ' 116' ' ' LEU . 9.7 tm-20 . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.205 -0.452 . . . . 71.1 110.883 179.937 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' -9' ' ' GLY . . . . . 0.52 ' H2 ' HD11 ' B' ' -6' ' ' ILE . . . . . . . . 0 N--CA 1.451 -0.312 0 N-CA-C 112.441 -0.263 . . . . 75.43 112.441 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 3.5 pttm -111.97 -25.71 9.26 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-O 120.845 0.355 . . . . 74.14 110.917 -179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 56.2 m-85 -72.04 -74.76 0.15 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 64.11 110.832 179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' -6' ' ' ILE . . . . . 0.52 HD11 ' H2 ' ' B' ' -9' ' ' GLY . 23.8 mm 51.31 77.97 0.43 Allowed Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.632 0.729 . . . . 53.22 111.131 -179.998 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 90.96 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.66 2.24 . . . . 53.42 112.32 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 16.3 t -102.79 34.56 2.79 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.216 -0.447 . . . . 72.02 110.853 -179.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' -3' ' ' ARG . . . . . 0.427 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 3.3 mtp85 -95.31 160.3 30.97 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.554 0.693 . . . . 74.45 110.93 -179.979 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' -2' ' ' PRO . . . . . 0.427 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.9 Cg_endo -69.78 102.51 1.04 Allowed 'Trans proline' 0 N--CA 1.466 -0.145 0 C-N-CA 122.718 2.279 . . . . 55.24 112.381 179.995 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -51.05 108.9 1.15 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.615 0.721 . . . . 64.3 111.139 179.891 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.71 150.94 69.18 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.745 2.297 . . . . 71.43 112.301 -179.965 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 2.6 mptm? -97.95 160.87 27.38 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.53 0.681 . . . . 73.12 110.92 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.76 167.88 23.16 Favored 'Trans proline' 0 C--O 1.231 0.172 0 C-N-CA 122.649 2.232 . . . . 74.03 112.368 179.87 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 150.7 68.6 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.61 2.207 . . . . 73.52 112.373 179.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 46.1 m -109.07 172.71 6.69 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.213 -0.449 . . . . 53.31 110.854 -179.836 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 19.4 t -116.28 -60.36 1.87 Allowed 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.111 -0.495 . . . . 73.42 110.834 -179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.163 -0.472 . . . . 74.52 111.15 179.846 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 21.4 ptm . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.801 0.334 . . . . 54.34 110.844 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . 0.574 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -146.09 160.43 43.05 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.548 0.689 . . . . 62.21 111.136 179.874 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.574 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.7 Cg_endo -69.79 78.75 1.0 Allowed 'Trans proline' 0 C--O 1.232 0.209 0 C-N-CA 122.71 2.273 . . . . 71.21 112.329 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.768 HD11 HG13 ' A' ' 28' ' ' ILE . 0.6 OUTLIER -88.56 156.13 19.24 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.217 -0.447 . . . . 65.32 110.889 179.98 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.638 ' CD1' HD13 ' A' ' 60' ' ' LEU . 95.0 m-85 -134.65 140.01 45.71 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.168 -0.469 . . . . 74.32 110.902 179.895 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -111.24 169.76 8.57 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.132 -0.485 . . . . 71.41 111.063 179.96 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.415 HG12 HG12 ' A' ' 58' ' ' ILE . 7.6 p -136.94 124.93 33.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.459 . . . . 61.52 111.1 -179.999 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.773 HG21 HG11 ' A' ' 20' ' ' VAL . 0.2 OUTLIER -73.07 147.48 44.96 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.172 -0.467 . . . . 74.44 111.161 179.988 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.511 HD11 ' HB2' ' A' ' 56' ' ' ARG . 18.0 mt -118.14 -11.82 10.1 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.234 -0.439 . . . . 73.14 110.909 179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.1 m-85 -140.18 166.91 23.39 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.206 -0.452 . . . . 74.34 110.967 179.986 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -89.88 110.04 21.01 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.134 -0.485 . . . . 64.23 110.896 -179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.469 ' HB3' HG12 ' A' ' 20' ' ' VAL . 23.0 t80 -91.43 116.15 28.61 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.171 -0.468 . . . . 75.54 110.887 -179.961 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -90.56 108.44 19.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.108 -0.497 . . . . 72.14 110.878 179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.27 158.98 15.94 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.222 -0.445 . . . . 75.25 111.09 179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 3.9 pm0 -124.68 -37.14 2.52 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.256 -0.429 . . . . 60.1 110.872 -179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.8 mmt180 -122.29 167.16 13.58 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.156 -0.475 . . . . 75.5 110.875 -179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 11.9 m-20 -53.63 -40.76 66.08 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.184 -0.462 . . . . 65.32 110.887 179.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 43.6 m-20 -65.04 -25.35 67.79 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.254 -0.43 . . . . 75.32 110.858 179.995 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -90.29 129.07 36.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.174 -0.466 . . . . 72.41 110.909 -179.906 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.561 HD13 ' O ' ' A' ' 46' ' ' GLY . 4.8 tp -108.29 145.07 34.92 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.127 -0.488 . . . . 61.03 110.879 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -89.09 150.26 22.82 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.202 -0.454 . . . . 75.32 110.876 179.795 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.773 HG11 HG21 ' A' ' 6' ' ' THR . 8.8 p -147.43 156.16 10.31 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.204 -0.453 . . . . 74.23 111.136 -179.974 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 14.1 p -111.02 154.51 43.41 Favored Pre-proline 0 C--N 1.329 -0.291 0 CA-C-O 121.638 0.732 . . . . 54.34 110.879 -179.834 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 128.17 15.66 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.691 2.261 . . . . 74.25 112.402 179.944 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.8 -2.93 60.48 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.794 -0.717 . . . . 63.03 112.521 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 4.4 mm-40 -85.6 158.41 20.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.846 0.355 . . . . 74.13 110.901 -179.883 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.488 ' C ' HD22 ' A' ' 26' ' ' LEU . 3.4 m120 -101.39 131.95 47.21 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.161 -0.472 . . . . 71.41 110.903 -179.947 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.819 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 3.1 mm? -123.66 159.97 28.18 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.161 -0.472 . . . . 74.14 110.918 -179.985 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -108.81 112.88 25.39 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.22 -0.446 . . . . 72.31 110.89 -179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.768 HG13 HD11 ' A' ' 2' ' ' LEU . 38.2 mm -70.88 143.27 14.66 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.126 -0.488 . . . . 71.35 111.169 179.94 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.2 m -122.92 -35.83 2.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.197 -0.456 . . . . 50.12 110.861 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.477 ' HB1' ' C ' ' A' ' 88' ' ' THR . . . -170.78 173.4 5.31 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 74.14 111.118 -179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.566 ' O ' HG23 ' A' ' 89' ' ' VAL . 1.8 p80 -128.12 176.18 7.85 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 73.11 110.859 179.992 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 29.7 t80 -137.78 99.86 4.03 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.225 -0.443 . . . . 73.21 110.902 -179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.5 t0 54.4 25.75 6.35 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.119 -0.491 . . . . 73.44 110.798 179.895 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.595 ' HD2' HD12 ' A' ' 81' ' ' ILE . 37.6 m-85 63.27 26.34 15.09 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.224 -0.443 . . . . 74.43 110.911 -179.894 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.466 ' O ' HG23 ' A' ' 52' ' ' VAL . 16.9 mm-40 -115.64 -46.56 2.85 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.103 -0.499 . . . . 72.42 110.882 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.413 ' HB3' HD21 ' A' ' 49' ' ' LEU . 82.5 m95 -114.73 146.95 40.36 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.177 -0.465 . . . . 75.41 110.894 -179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.62 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -123.82 143.66 50.19 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.227 -0.442 . . . . 71.11 110.902 -179.999 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.45 HG21 ' CZ3' ' A' ' 92' ' ' TRP . 19.6 mm -101.22 98.49 6.93 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.172 -0.467 . . . . 43.44 111.131 -179.984 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.819 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.86 138.36 47.36 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.155 -0.475 . . . . 62.42 111.131 179.808 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -112.59 157.56 39.94 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.571 0.7 . . . . 70.12 110.906 179.943 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.73 131.24 20.87 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.659 2.239 . . . . 62.02 112.388 179.84 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.468 HD12 ' CB ' ' A' ' 25' ' ' ASN . 35.9 mt -90.09 -31.95 5.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.227 -0.442 . . . . 74.12 111.134 179.936 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' A ASN . . . . . . . . . . . . . 11.4 t-20 -90.92 -53.7 4.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.164 -0.471 . . . . 73.21 110.865 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' B ARG . . . . . . . . . . . . . 22.7 mmt180 -61.05 -169.43 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.174 -0.466 . . . . 74.54 110.901 -179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 6.3 mt -92.76 -169.34 2.16 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.184 -0.462 . . . . 72.01 110.898 -179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -58.78 108.48 1.57 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.746 -0.74 . . . . 55.31 112.521 179.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.561 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -158.11 66.52 0.29 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.768 -0.73 . . . . 62.23 112.496 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.85 117.41 5.07 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.699 2.266 . . . . 63.04 112.312 -179.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -117.68 -166.87 14.07 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.776 -0.726 . . . . 43.33 112.541 179.949 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.505 HD12 ' CD2' ' B' ' -7' ' ' PHE . 0.4 OUTLIER -120.9 124.83 45.93 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.897 0.38 . . . . 63.22 110.857 -179.898 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.435 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.2 p -134.94 133.13 20.75 Favored Pre-proline 0 C--N 1.33 -0.271 0 CA-C-O 121.635 0.731 . . . . 71.21 111.132 179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.494 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.6 Cg_endo -69.75 153.87 68.44 Favored 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.721 2.281 . . . . 75.54 112.332 179.963 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.744 HG12 ' HB ' ' A' ' 71' ' ' THR . 11.8 t -65.55 -21.65 29.53 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.204 -0.453 . . . . 72.23 111.151 179.896 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 7.1 m -78.57 -1.86 36.06 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.203 -0.453 . . . . 62.14 110.8 -179.807 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 11.7 m-85 -121.38 2.18 10.23 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.185 -0.461 . . . . 62.23 110.921 -179.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.494 HG22 ' O ' ' A' ' 51' ' ' PRO . 17.0 m -139.45 160.16 28.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.114 -0.493 . . . . 62.31 111.111 179.903 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.511 ' HB2' HD11 ' A' ' 7' ' ' LEU . 17.9 ttm180 -127.26 123.64 36.94 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.167 -0.47 . . . . 71.54 110.862 -179.962 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.482 HD11 ' CE2' ' A' ' 37' ' ' PHE . 24.8 mm -74.39 110.29 8.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.165 -0.471 . . . . 35.11 111.129 179.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.449 HG23 ' HG2' ' A' ' 56' ' ' ARG . 6.7 pt -124.27 -177.87 1.68 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.155 -0.475 . . . . 75.32 111.138 179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.7 t0 -128.64 145.9 51.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.186 -0.461 . . . . 71.55 110.908 179.819 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.638 HD13 ' CD1' ' A' ' 3' ' ' PHE . 1.5 mp -73.29 -38.3 65.92 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.201 -0.454 . . . . 71.21 110.926 -179.964 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -76.83 -24.12 52.73 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 72.44 110.912 179.847 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 8.6 t0 -155.31 75.96 5.16 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.626 0.727 . . . . 73.44 110.856 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.718 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 54.3 Cg_endo -69.72 -8.32 23.31 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.663 2.242 . . . . 64.33 112.367 -179.998 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.81 -15.36 23.83 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.218 -0.447 . . . . 44.31 111.085 179.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 12.3 ttmt -77.73 -51.66 10.2 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.252 -0.431 . . . . 64.33 110.914 179.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.429 ' HA ' HG23 ' A' ' 69' ' ' VAL . 57.1 m-85 -95.35 23.15 6.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.255 -0.429 . . . . 74.45 110.915 -179.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.718 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -88.03 -23.81 23.67 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.095 -0.502 . . . . 70.21 111.1 179.853 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 13.0 p -91.68 -9.72 42.85 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.213 -0.449 . . . . 65.31 110.835 -179.8 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.429 HG23 ' HA ' ' A' ' 66' ' ' TYR . 55.2 t -51.49 139.94 6.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.14 -0.482 . . . . 65.5 111.101 179.956 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 68.8 m-20 -94.77 75.42 3.65 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.152 -0.476 . . . . 73.41 110.867 179.926 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.744 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -46.92 -34.58 5.6 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.242 -0.436 . . . . 65.43 111.127 -179.886 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 20.4 t80 -57.94 -45.19 86.97 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.212 -0.449 . . . . 71.32 110.903 -179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -69.67 114.82 8.23 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.471 . . . . 74.53 110.903 179.886 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.08 -23.98 37.19 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.214 -0.448 . . . . 71.01 110.858 -179.871 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 8.3 mt-10 -66.81 -57.68 6.56 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.194 -0.457 . . . . 74.21 110.843 -179.862 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.692 ' O ' HD12 ' A' ' 80' ' ' ILE . 4.2 mm-40 -57.64 -57.59 12.07 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.17 -0.468 . . . . 70.03 110.944 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.7 p -51.43 -32.12 12.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.175 -0.466 . . . . 72.22 111.162 179.964 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.7 mtm -68.17 -51.64 43.47 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.152 -0.476 . . . . 73.4 110.852 179.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.9 mttm -55.83 -42.67 76.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.201 -0.454 . . . . 74.02 110.904 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.692 HD12 ' O ' ' A' ' 76' ' ' GLN . 1.6 mp -64.79 -55.04 23.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.243 -0.435 . . . . 53.03 111.149 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.595 HD12 ' HD2' ' A' ' 34' ' ' TYR . 90.5 mt -57.7 -37.53 59.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.159 -0.473 . . . . 74.34 111.087 179.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 6.4 t70 -71.08 -52.02 21.79 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.206 -0.452 . . . . 73.42 110.896 179.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 48.3 mm-40 -58.94 -51.35 70.43 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.162 -0.472 . . . . 65.34 110.844 -179.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -68.66 -14.1 62.8 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.145 -0.479 . . . . 71.53 110.883 -179.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 2.3 mptp? 58.76 54.23 5.38 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 74.51 110.914 179.97 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.537 ' HB ' HG23 ' A' ' 81' ' ' ILE . 22.6 mt -81.74 131.19 58.3 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.655 0.74 . . . . 75.24 111.134 179.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 158.23 57.66 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.685 2.257 . . . . 71.22 112.363 179.873 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.477 ' C ' ' HB1' ' A' ' 30' ' ' ALA . 0.1 OUTLIER -85.37 169.94 13.21 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.202 -0.454 . . . . 74.2 111.164 -179.957 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.829 HG12 ' HE2' ' A' ' 93' ' ' LYS . 25.4 t -51.51 -52.04 22.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.224 -0.444 . . . . 71.33 111.116 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -59.87 -47.48 85.59 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.141 -0.481 . . . . 42.13 110.891 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 50.6 mm-40 -57.48 -27.84 62.87 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.127 -0.488 . . . . 45.01 110.94 -179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.45 ' CZ3' HG21 ' A' ' 38' ' ' ILE . 26.8 t90 -73.27 -48.01 38.24 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.164 -0.471 . . . . 72.53 110.94 179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.829 ' HE2' HG12 ' A' ' 89' ' ' VAL . 11.6 mtmt -64.86 -39.97 94.4 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.219 -0.446 . . . . 75.13 110.905 179.931 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -70.23 -43.51 70.45 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.178 -0.464 . . . . 72.32 110.867 179.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 39.7 mm-40 -61.37 -45.96 92.19 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.18 -0.464 . . . . 72.11 110.917 -179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 9.3 p -68.67 -40.92 79.92 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 73.31 111.141 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 15.2 mmt85 -62.96 -37.46 87.17 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.178 -0.465 . . . . 72.23 110.899 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -84.62 -23.96 29.33 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.214 -0.448 . . . . 64.14 110.88 -179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 33.8 t80 -82.84 -23.45 33.73 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.183 -0.462 . . . . 74.13 110.898 -179.837 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 2.9 mptp? -97.02 -18.87 19.13 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.125 -0.489 . . . . 74.42 110.946 179.876 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -53.86 174.91 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.185 -0.461 . . . . 65.12 110.9 179.946 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.3 m 63.38 42.35 6.88 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.156 -0.474 . . . . 74.51 110.87 -179.791 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 16.0 m -74.66 -168.94 0.77 Allowed 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.118 -0.492 . . . . 74.21 110.888 -179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.448 HG22 ' N ' ' A' ' 105' ' ' GLN . 10.3 mt -79.86 158.66 4.47 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.151 -0.477 . . . . 73.33 111.154 179.928 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.448 ' N ' HG22 ' A' ' 104' ' ' ILE . 6.6 pt20 -48.86 157.54 0.39 Allowed 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.184 -0.462 . . . . 50.24 110.9 179.899 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -147.19 179.93 0.8 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.202 -0.454 . . . . 73.14 111.124 179.937 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -54.51 -77.79 0.14 Allowed Glycine 0 N--CA 1.451 -0.353 0 C-N-CA 120.772 -0.728 . . . . 74.33 112.473 179.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 13.9 p-10 -113.9 150.05 34.24 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-O 120.862 0.363 . . . . 73.13 110.908 -179.887 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -156.98 -120.75 0.65 Allowed Glycine 0 N--CA 1.451 -0.303 0 C-N-CA 120.74 -0.743 . . . . 64.32 112.477 179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 10.0 m-70 -54.41 171.04 0.13 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.823 0.344 . . . . 72.32 110.845 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -160.05 167.52 35.47 Favored Glycine 0 N--CA 1.452 -0.263 0 C-N-CA 120.725 -0.75 . . . . 60.33 112.491 -179.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 4.5 tt0 -51.34 134.43 28.15 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.798 0.332 . . . . 63.14 110.901 -179.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 7.4 p -99.45 -177.92 3.74 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.24 -0.437 . . . . 72.11 110.826 -179.781 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 23.4 tt0 -147.78 149.44 32.36 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.094 -0.503 . . . . 73.54 110.891 -179.974 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -111.03 132.54 11.0 Favored Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.757 -0.735 . . . . 52.03 112.522 -179.984 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.462 ' H ' HD12 ' A' ' 116' ' ' LEU . 0.6 OUTLIER -102.72 -65.03 1.02 Allowed 'General case' 0 C--N 1.328 -0.338 0 CA-C-O 120.804 0.335 . . . . 65.42 110.931 -179.927 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 14.3 tm-20 . . . . . 0 C--N 1.33 -0.258 0 CA-C-N 116.128 -0.487 . . . . 65.43 110.891 179.937 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' -9' ' ' GLY . . . . . 0.637 ' HA3' HD11 ' B' ' -6' ' ' ILE . . . . . . . . 0 N--CA 1.451 -0.353 0 N-CA-C 112.521 -0.231 . . . . 74.43 112.521 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -92.66 -45.61 7.98 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.813 0.34 . . . . 74.22 110.913 -179.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' -7' ' ' PHE . . . . . 0.505 ' CD2' HD12 ' A' ' 49' ' ' LEU . 28.8 m-85 -84.79 -75.04 0.37 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 73.25 110.837 179.978 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' -6' ' ' ILE . . . . . 0.637 HD11 ' HA3' ' B' ' -9' ' ' GLY . 27.9 mm 51.39 76.21 0.57 Allowed Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.573 0.701 . . . . 43.3 111.153 179.99 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 104.58 1.34 Allowed 'Trans proline' 0 C--N 1.341 0.149 0 C-N-CA 122.693 2.262 . . . . 75.12 112.354 179.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 31.0 t -96.47 5.08 51.58 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.218 -0.446 . . . . 54.41 110.829 -179.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -51.68 162.15 0.78 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.637 0.732 . . . . 74.32 110.891 -179.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -19.09 36.76 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.669 2.246 . . . . 74.11 112.357 -179.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 63.69 82.6 0.21 Allowed Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.628 0.728 . . . . 62.44 111.117 179.881 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 140.75 43.47 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.681 2.254 . . . . 53.11 112.349 -179.99 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 26.3 mtmm -72.14 160.72 81.95 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.582 0.706 . . . . 55.35 110.889 179.905 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 167.75 23.54 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.704 2.269 . . . . 64.02 112.329 179.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 86.5 0.58 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.638 2.226 . . . . 65.45 112.367 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 61.4 p -91.07 -175.75 4.4 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.202 -0.454 . . . . 52.02 110.858 -179.836 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.2 -33.67 20.71 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.112 -0.495 . . . . 51.52 110.874 -179.881 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.306 0 CA-C-N 116.171 -0.468 . . . . 72.43 111.082 179.91 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--O 1.231 0.107 0 CA-C-O 120.763 0.316 . . . . 61.53 110.88 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . 0.588 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -104.12 160.38 26.26 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.562 0.696 . . . . 75.14 111.113 179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.588 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.7 Cg_endo -69.74 131.97 22.37 Favored 'Trans proline' 0 C--O 1.232 0.204 0 C-N-CA 122.684 2.256 . . . . 70.54 112.342 179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.5 pp -134.18 145.35 49.14 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.214 -0.448 . . . . 73.23 110.885 179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 17.7 m-85 -128.97 148.17 50.92 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.194 -0.457 . . . . 71.3 110.902 179.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.439 ' HB2' ' CD1' ' A' ' 28' ' ' ILE . . . -122.7 168.6 12.01 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.137 -0.483 . . . . 73.25 111.09 179.939 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 6.4 p -134.27 130.17 54.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.197 -0.456 . . . . 64.11 111.127 179.978 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.738 HG21 HG11 ' A' ' 20' ' ' VAL . 0.9 OUTLIER -72.74 142.47 48.15 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.173 -0.467 . . . . 73.43 111.143 -179.977 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.74 HD11 ' HB2' ' A' ' 56' ' ' ARG . 5.7 mt -117.6 -17.1 10.04 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.207 -0.452 . . . . 70.43 110.91 179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 42.7 m-85 -129.29 167.95 16.94 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.178 -0.465 . . . . 74.14 110.949 179.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 11.7 tp10 -92.14 112.19 24.03 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.119 -0.491 . . . . 74.24 110.868 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 3.6 t80 -92.17 123.16 35.31 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.129 -0.487 . . . . 72.01 110.92 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.9 mttt -101.96 101.01 11.35 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.172 -0.467 . . . . 75.23 110.958 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.451 ' HB1' ' HB3' ' A' ' 17' ' ' GLU . . . -61.17 155.65 20.22 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.235 -0.439 . . . . 72.3 111.109 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -122.72 -35.99 2.97 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.224 -0.444 . . . . 75.22 110.841 -179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.2 mmt85 -121.67 -176.49 3.33 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.156 -0.475 . . . . 71.1 110.844 -179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 88.8 m-20 -68.23 -38.45 81.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.205 -0.452 . . . . 65.11 110.855 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.8 p30 -63.7 -32.95 74.6 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.155 -0.475 . . . . 71.14 110.846 -179.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.451 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 0.6 OUTLIER -79.3 147.71 32.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.436 . . . . 75.34 110.846 -179.888 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.413 HD22 ' HA3' ' A' ' 48' ' ' GLY . 8.7 tp -127.5 121.6 31.15 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.113 -0.494 . . . . 74.14 110.909 -179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 2.6 p30 -77.32 144.07 38.32 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.236 -0.438 . . . . 72.22 110.882 179.84 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.738 HG11 HG21 ' A' ' 6' ' ' THR . 7.0 p -149.89 154.71 8.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 62.14 111.176 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 31.0 m -105.84 156.14 37.11 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.715 0.769 . . . . 74.44 110.864 -179.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.86 139.88 40.96 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.703 2.269 . . . . 74.0 112.341 -179.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 93.35 -4.99 74.32 Favored Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.741 -0.742 . . . . 64.04 112.461 -179.982 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 31.4 mm-40 -89.54 146.08 24.84 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.868 0.366 . . . . 74.34 110.918 -179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -89.76 123.7 33.99 Favored 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.194 -0.457 . . . . 65.41 110.884 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.782 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 3.3 mm? -116.08 145.64 42.86 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 72.43 110.877 179.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.2 t -101.24 112.89 25.51 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.154 -0.475 . . . . 45.35 110.862 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.439 ' CD1' ' HB2' ' A' ' 4' ' ' ALA . 56.6 mt -78.36 144.57 11.02 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.099 -0.5 . . . . 74.42 111.141 179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 26.2 m -117.95 -41.94 2.86 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.18 -0.464 . . . . 73.4 110.837 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -157.37 175.35 14.11 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.162 -0.472 . . . . 54.21 111.081 179.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.411 ' O ' HG22 ' A' ' 88' ' ' THR . 2.4 p80 -127.22 178.52 5.98 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.186 -0.461 . . . . 75.44 110.838 -179.98 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 36.5 t80 -150.88 107.22 3.47 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.212 -0.449 . . . . 74.43 110.951 -179.854 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 57.62 20.07 5.96 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.143 -0.481 . . . . 73.41 110.906 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.636 ' HD2' HD12 ' A' ' 81' ' ' ILE . 32.7 m-85 58.84 21.88 9.55 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.168 -0.469 . . . . 72.33 110.912 -179.835 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 3.2 pt-20 -118.17 -24.81 6.84 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 71.12 110.866 -179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.1 m95 -130.23 135.87 48.6 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.19 -0.459 . . . . 73.23 110.903 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.614 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -118.56 138.79 52.3 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.254 -0.43 . . . . 74.44 110.859 -179.942 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.2 mm -93.77 94.17 4.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.171 -0.468 . . . . 71.45 111.119 179.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.782 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -109.97 149.64 29.65 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.155 -0.475 . . . . 73.32 111.11 179.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.2 pttp -124.9 158.01 64.42 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.576 0.703 . . . . 74.44 110.913 179.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 153.94 68.29 Favored 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.671 2.248 . . . . 73.11 112.343 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.416 HG22 ' O ' ' A' ' 42' ' ' ILE . 29.0 mt -120.03 -9.51 10.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.207 -0.451 . . . . 72.01 111.118 179.931 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' A ASN . . . . . . . . . . . . . 27.7 m-20 -118.1 -49.36 2.51 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.164 -0.471 . . . . 72.33 110.874 179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' B ARG . . . . . 0.658 ' C ' HD12 ' A' ' 44' ' ' LEU . 1.2 mtm105 -51.52 -70.02 0.1 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.192 -0.458 . . . . 74.21 110.878 179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.658 HD12 ' C ' ' A' ' 43' B ARG . 5.5 mp -151.64 -75.8 0.14 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.144 -0.48 . . . . 75.33 110.903 179.993 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 142.08 66.04 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.343 0 C-N-CA 120.808 -0.71 . . . . 73.43 112.538 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -122.51 154.49 16.94 Favored Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.756 -0.735 . . . . 71.12 112.51 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 114.19 3.62 Favored 'Trans proline' 0 N--CA 1.465 -0.16 0 C-N-CA 122.719 2.279 . . . . 52.31 112.351 -179.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.413 ' HA3' HD22 ' A' ' 18' ' ' LEU . . . -121.79 163.69 15.15 Favored Glycine 0 N--CA 1.451 -0.348 0 C-N-CA 120.697 -0.763 . . . . 34.43 112.476 -179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.558 HD12 ' HB3' ' B' ' -7' ' ' PHE . 1.0 OUTLIER -108.89 124.68 51.03 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-O 120.853 0.359 . . . . 73.3 110.933 -179.938 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.444 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.2 p -143.3 133.21 11.94 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.665 0.745 . . . . 53.23 111.119 179.857 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.444 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.2 Cg_endo -69.76 152.42 69.29 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.707 2.271 . . . . 52.44 112.284 179.995 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.73 HG12 ' HB ' ' A' ' 71' ' ' THR . 12.4 t -64.92 -20.75 28.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.199 -0.455 . . . . 60.13 111.132 179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 13.6 m -79.56 0.41 29.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.171 -0.468 . . . . 74.41 110.837 -179.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.402 ' CD1' ' HG2' ' A' ' 51' ' ' PRO . 27.5 m-85 -127.63 18.61 6.81 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 72.2 110.926 -179.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 18.5 m -151.9 160.29 3.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 CA-C-N 116.097 -0.501 . . . . 74.43 111.109 179.894 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.74 ' HB2' HD11 ' A' ' 7' ' ' LEU . 20.1 ttp180 -123.62 129.43 51.14 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.171 -0.468 . . . . 74.15 110.885 -179.97 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 44.6 mm -81.89 111.95 19.1 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.197 -0.456 . . . . 72.43 111.169 179.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.589 HG23 ' HG2' ' A' ' 56' ' ' ARG . 13.6 pt -129.98 -178.28 2.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.185 -0.461 . . . . 54.45 111.125 179.903 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -129.15 129.63 45.37 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.189 -0.46 . . . . 75.31 110.85 179.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.4 mt -55.19 -26.2 37.52 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.232 -0.44 . . . . 64.51 110.89 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -91.51 -30.77 16.24 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.225 -0.443 . . . . 72.11 110.873 179.85 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -141.05 73.92 26.03 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.578 0.704 . . . . 75.45 110.862 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.641 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.8 Cg_endo -69.8 -13.77 35.02 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.66 2.24 . . . . 64.35 112.312 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.99 -16.14 20.75 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.237 -0.438 . . . . 61.33 111.122 179.869 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 15.9 ttmt -74.26 -52.17 13.14 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.224 -0.444 . . . . 73.25 110.89 179.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.618 ' O ' HG12 ' A' ' 69' ' ' VAL . 68.0 m-85 -95.41 23.17 6.15 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.195 -0.457 . . . . 64.42 110.931 -179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.641 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -87.0 -18.76 29.9 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.094 -0.503 . . . . 52.24 111.068 179.891 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 4.3 p -95.93 -21.22 18.19 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.24 -0.436 . . . . 64.04 110.825 -179.778 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.937 HG21 HD11 ' A' ' 80' ' ' ILE . 9.6 p -51.45 145.54 2.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.138 -0.483 . . . . 71.41 111.107 -179.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -95.44 106.43 18.5 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.173 -0.467 . . . . 71.05 110.852 179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.73 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -70.59 -35.79 73.2 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.212 -0.449 . . . . 74.45 111.097 -179.861 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 10.9 t80 -60.66 -41.52 95.18 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.186 -0.461 . . . . 70.42 110.928 -179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 57.4 t0 -63.94 107.85 1.34 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.138 -0.483 . . . . 72.43 110.854 179.927 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.15 -27.08 31.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.214 -0.448 . . . . 61.24 110.868 -179.877 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 24.8 mt-10 -67.15 -55.26 14.92 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.218 -0.446 . . . . 65.33 110.912 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 8.9 mt-30 -59.71 -56.58 20.05 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.152 -0.476 . . . . 71.22 110.879 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.48 ' HA ' HD12 ' A' ' 80' ' ' ILE . 2.4 p -52.81 -31.7 16.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.157 -0.474 . . . . 51.21 111.131 179.987 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 11.4 mtm -68.02 -56.08 10.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.173 -0.467 . . . . 61.05 110.932 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 41.1 mttm -54.84 -36.96 65.59 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.172 -0.467 . . . . 75.44 110.919 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.937 HD11 HG21 ' A' ' 69' ' ' VAL . 27.0 mt -66.91 -55.18 18.89 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.197 -0.456 . . . . 71.12 111.116 179.867 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.701 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.9 mt -60.57 -36.05 67.56 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.187 -0.461 . . . . 72.12 111.092 179.882 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.4 t0 -71.27 -50.17 35.44 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.189 -0.46 . . . . 74.53 110.864 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -62.82 -47.04 85.14 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.172 -0.467 . . . . 62.21 110.884 -179.94 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -70.72 -14.08 62.31 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.172 -0.467 . . . . 63.22 110.908 -179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.85 54.94 4.85 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.483 . . . . 74.44 110.856 179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.701 ' HB ' HG23 ' A' ' 81' ' ' ILE . 49.9 mt -85.12 132.18 46.27 Favored Pre-proline 0 C--N 1.328 -0.341 0 CA-C-O 121.602 0.715 . . . . 62.23 111.125 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 161.07 47.36 Favored 'Trans proline' 0 C--O 1.232 0.219 0 C-N-CA 122.671 2.247 . . . . 65.12 112.361 179.863 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.411 HG22 ' O ' ' A' ' 31' ' ' HIS . 0.2 OUTLIER -97.31 165.67 11.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.248 -0.433 . . . . 73.42 111.203 179.989 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 87.2 t -50.84 -52.66 16.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.262 -0.427 . . . . 60.32 111.112 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 53.2 mt-10 -52.22 -52.17 53.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.175 -0.466 . . . . 72.02 110.931 179.99 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 69.8 mm-40 -58.04 -42.75 86.05 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.148 -0.478 . . . . 74.43 110.912 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.434 ' O ' HG23 ' A' ' 96' ' ' THR . 55.5 t90 -65.32 -36.26 83.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.219 -0.446 . . . . 73.12 110.94 -179.988 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.5 mmpt? -68.29 -37.82 81.05 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.209 -0.451 . . . . 64.54 110.907 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 24.3 t0 -69.81 -50.52 42.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.214 -0.448 . . . . 62.53 110.885 179.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.4 ' HG2' ' HA ' ' A' ' 92' ' ' TRP . 4.3 pt20 -59.89 -39.66 86.12 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.165 -0.47 . . . . 74.35 110.901 -179.983 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.434 HG23 ' O ' ' A' ' 92' ' ' TRP . 30.8 p -70.43 -41.1 73.32 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.231 -0.44 . . . . 73.32 111.163 -179.911 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -60.9 -45.26 95.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 73.12 110.915 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 8.1 ptm180 -75.67 -31.11 59.63 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.143 -0.48 . . . . 73.1 110.839 -179.924 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 50.1 t80 -71.77 -38.69 70.3 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.225 -0.443 . . . . 72.31 110.891 -179.858 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.6 mtpp -66.68 -14.48 62.54 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.13 -0.486 . . . . 72.51 110.881 179.934 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 69.5 mm-40 -60.17 -169.53 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.282 -0.417 . . . . 74.44 110.842 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 88.1 p -48.96 105.55 0.08 Allowed 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.132 -0.485 . . . . 53.21 110.843 -179.762 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 4.3 m -158.18 -169.3 2.74 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.116 -0.493 . . . . 51.31 110.867 -179.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.463 HG22 ' N ' ' A' ' 105' ' ' GLN . 19.6 mt -73.63 156.49 6.58 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.14 -0.482 . . . . 71.24 111.134 179.952 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.609 ' O ' HD13 ' A' ' 106' ' ' ILE . 22.4 mt-30 -49.42 166.41 0.05 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.201 -0.454 . . . . 53.13 110.934 179.942 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.609 HD13 ' O ' ' A' ' 105' ' ' GLN . 25.3 mm -137.07 -69.12 0.24 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.219 -0.446 . . . . 75.22 111.114 179.955 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 153.01 -33.8 0.79 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.76 -0.733 . . . . 65.23 112.515 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 35.3 t30 -119.42 149.93 41.04 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.881 0.372 . . . . 75.31 110.905 -179.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -152.57 145.62 13.37 Favored Glycine 0 N--CA 1.452 -0.266 0 C-N-CA 120.696 -0.764 . . . . 61.25 112.468 179.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 29.3 m80 -153.66 -179.47 7.83 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.783 0.325 . . . . 65.12 110.911 -179.969 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 174.03 145.02 5.03 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.761 -0.733 . . . . 74.04 112.492 -179.988 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 8.0 mm100 -146.74 179.88 7.27 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-O 120.802 0.334 . . . . 73.21 110.93 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 35.4 m -163.05 157.97 21.47 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.204 -0.453 . . . . 75.22 110.871 -179.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 42.3 mt-30 -148.19 178.62 8.41 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.164 -0.471 . . . . 71.15 110.923 -179.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 154.94 117.66 0.61 Allowed Glycine 0 N--CA 1.452 -0.265 0 C-N-CA 120.768 -0.73 . . . . 53.04 112.486 -179.958 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.408 ' O ' HD12 ' A' ' 116' ' ' LEU . 0.6 OUTLIER -165.06 158.24 16.61 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.806 0.336 . . . . 71.2 110.875 -179.91 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 16.2 pt-20 . . . . . 0 C--N 1.329 -0.301 0 CA-C-N 116.149 -0.478 . . . . 53.34 110.897 179.902 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.341 0 N-CA-C 112.476 -0.25 . . . . 51.23 112.476 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 22.8 mtpt -86.14 -39.2 16.94 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.842 0.354 . . . . 71.13 110.909 -179.992 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' -7' ' ' PHE . . . . . 0.558 ' HB3' HD12 ' A' ' 49' ' ' LEU . 31.3 m-85 -94.27 -76.58 0.48 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.45 . . . . 72.43 110.896 179.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 22.1 mm 50.25 78.22 0.41 Allowed Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.611 0.719 . . . . 55.11 111.14 179.95 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 97.09 0.62 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.661 2.241 . . . . 64.44 112.337 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 28.7 t -95.99 3.28 53.6 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.197 -0.456 . . . . 70.14 110.863 -179.848 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -51.54 162.39 0.71 Allowed Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.637 0.732 . . . . 74.25 110.874 -179.944 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 -17.94 37.17 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.674 2.249 . . . . 71.52 112.322 -179.967 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 63.89 84.04 0.19 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.618 0.723 . . . . 60.03 111.097 179.873 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 140.01 41.79 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.696 2.264 . . . . 64.02 112.36 179.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 36.5 mtmt -73.6 160.59 81.87 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.602 0.715 . . . . 73.04 110.909 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 167.1 25.47 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.667 2.245 . . . . 74.22 112.323 179.893 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.7 -31.41 20.86 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 122.703 2.269 . . . . 74.11 112.401 179.915 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 19.4 m -97.47 64.32 1.84 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.193 -0.458 . . . . 50.32 110.831 -179.849 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 7.3 t -70.3 127.23 32.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.14 -0.482 . . . . 60.41 110.854 -179.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.295 0 CA-C-N 116.112 -0.494 . . . . 54.35 111.071 179.937 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.76 0.314 . . . . 70.3 110.903 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . 0.588 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -137.33 160.37 65.84 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.566 0.698 . . . . 53.4 111.071 179.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.588 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.4 Cg_endo -69.76 140.84 43.65 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.715 2.277 . . . . 54.15 112.324 -179.98 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.568 ' CD1' HD12 ' A' ' 28' ' ' ILE . 1.1 pp -140.41 147.27 39.46 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.209 -0.45 . . . . 75.32 110.924 -179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -126.03 156.65 39.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.178 -0.464 . . . . 61.14 110.848 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.924 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -133.43 156.05 48.41 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.147 -0.479 . . . . 63.0 111.088 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.473 HG13 ' HB3' ' A' ' 56' ' ' ARG . 6.1 p -123.36 121.63 63.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 73.44 111.187 179.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.703 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.3 OUTLIER -64.95 140.73 58.9 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.186 -0.461 . . . . 75.33 111.169 -179.952 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.76 HD11 ' HB2' ' A' ' 56' ' ' ARG . 8.2 mt -116.71 -13.87 10.8 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.262 -0.426 . . . . 73.32 110.923 179.97 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 22.3 m-85 -134.98 158.58 43.97 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.172 -0.467 . . . . 72.1 110.939 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -83.56 105.22 14.31 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.117 -0.492 . . . . 64.03 110.897 179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 12.7 t80 -86.64 132.86 33.77 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.159 -0.473 . . . . 74.43 110.904 -179.944 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -113.01 98.61 7.27 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.172 -0.467 . . . . 62.13 110.873 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -53.13 159.45 1.25 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.264 -0.426 . . . . 60.15 111.096 179.817 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 2.9 pp20? -116.4 -23.93 8.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.179 -0.464 . . . . 52.11 110.895 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.5 mmm-85 -141.14 -177.51 5.14 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.173 -0.467 . . . . 74.32 110.86 -179.891 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -58.18 -46.08 86.4 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.184 -0.462 . . . . 65.14 110.875 -179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -52.32 -52.65 51.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.183 -0.462 . . . . 74.25 110.844 -179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 24.9 mp0 -67.01 151.16 48.17 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 50.43 110.872 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 11.0 tp -125.87 151.71 46.51 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.155 -0.475 . . . . 75.23 110.886 -179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.1 t70 -95.13 142.25 27.79 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.186 -0.461 . . . . 54.32 110.867 179.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.736 HG21 HD11 ' A' ' 26' ' ' LEU . 14.6 p -152.45 150.14 13.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-N 116.18 -0.464 . . . . 74.13 111.128 179.998 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.3 m -105.96 159.64 28.94 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.682 0.753 . . . . 73.23 110.84 -179.818 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.68 121.82 8.52 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.732 2.288 . . . . 62.4 112.363 179.943 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.13 1.77 31.58 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.68 -0.771 . . . . 71.11 112.483 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 51.9 mm-40 -92.14 156.96 16.99 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.855 0.359 . . . . 60.52 110.869 -179.841 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.0 m120 -100.88 131.69 46.64 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.143 -0.48 . . . . 72.41 110.921 -179.947 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.736 HD11 HG21 ' A' ' 20' ' ' VAL . 4.7 mp -130.83 146.27 52.22 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.207 -0.451 . . . . 70.14 110.896 -179.996 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.14 115.97 31.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.138 -0.483 . . . . 72.12 110.876 -179.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.924 HD11 ' HB2' ' A' ' 4' ' ' ALA . 43.9 mt -80.8 150.46 4.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.154 -0.475 . . . . 74.12 111.12 179.963 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 24.7 m -123.93 -41.7 2.21 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.182 -0.463 . . . . 55.43 110.868 179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -154.63 -178.42 7.17 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.21 -0.45 . . . . 54.32 111.124 -179.993 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.619 ' O ' HG23 ' A' ' 89' ' ' VAL . 1.8 p80 -134.62 175.25 9.71 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.252 -0.431 . . . . 73.45 110.858 -179.997 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.466 ' OH ' HG23 ' B' ' -6' ' ' ILE . 33.4 t80 -137.39 100.29 4.2 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.233 -0.44 . . . . 73.54 110.929 -179.871 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 55.58 25.63 8.21 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.098 -0.501 . . . . 74.0 110.886 179.913 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.57 ' HD2' HD12 ' A' ' 81' ' ' ILE . 35.0 m-85 63.61 16.4 9.64 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.199 -0.455 . . . . 73.13 110.935 -179.807 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.627 ' O ' HG23 ' A' ' 52' ' ' VAL . 10.0 mm-40 -104.03 -54.89 2.47 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.123 -0.489 . . . . 54.25 110.886 -179.99 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 39.1 m95 -105.65 151.7 24.06 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.156 -0.475 . . . . 75.14 110.935 -179.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.8 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -124.75 135.89 53.38 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.257 -0.429 . . . . 62.24 110.874 -179.958 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 26.7 mm -93.13 95.98 5.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.164 -0.471 . . . . 71.44 111.136 179.989 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.547 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -113.79 153.96 28.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 71.1 111.109 179.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 4.7 ptmt -126.73 157.6 70.76 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.568 0.699 . . . . 64.12 110.882 179.961 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 130.92 20.22 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.666 2.244 . . . . 75.33 112.346 179.879 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 76.9 mt -98.76 -38.18 6.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.262 -0.427 . . . . 62.34 111.11 179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' A ASN . . . . . . . . . . . . . 40.1 t-20 -101.68 -36.5 8.71 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.182 -0.463 . . . . 71.32 110.893 179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' B ARG . . . . . 0.661 ' C ' HD22 ' A' ' 44' ' ' LEU . 5.0 mmp_? -71.18 -176.96 1.57 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.203 -0.453 . . . . 74.4 110.84 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.661 HD22 ' C ' ' A' ' 43' B ARG . 4.2 mm? -128.15 121.8 30.42 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.181 -0.463 . . . . 74.22 110.907 -179.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 172.03 -107.65 0.26 Allowed Glycine 0 N--CA 1.451 -0.338 0 C-N-CA 120.726 -0.75 . . . . 41.33 112.501 179.881 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -173.63 172.91 45.58 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.74 -0.743 . . . . 74.45 112.487 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.81 124.74 11.36 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.694 2.263 . . . . 73.23 112.304 -179.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -116.11 -122.46 3.44 Favored Glycine 0 N--CA 1.452 -0.285 0 C-N-CA 120.728 -0.749 . . . . 23.13 112.471 179.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -153.69 124.79 7.38 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-O 120.837 0.351 . . . . 41.44 110.932 -179.909 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 9.0 p -134.87 132.76 20.6 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.646 0.736 . . . . 72.2 111.152 179.833 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.474 ' O ' HG22 ' A' ' 55' ' ' VAL . 54.0 Cg_endo -69.7 150.49 68.67 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.711 2.274 . . . . 74.42 112.381 179.944 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.8 HG22 ' CD2' ' A' ' 37' ' ' PHE . 52.9 t -58.17 -22.6 19.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.237 -0.438 . . . . 75.51 111.134 179.889 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 49.6 m -77.93 -3.89 44.11 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.456 . . . . 74.0 110.829 -179.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.639 ' O ' HG22 ' A' ' 6' ' ' THR . 14.9 m-85 -122.25 18.6 10.69 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.178 -0.465 . . . . 73.23 110.935 -179.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.474 HG22 ' O ' ' A' ' 51' ' ' PRO . 3.8 m -153.92 140.07 11.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.135 -0.484 . . . . 71.32 111.097 179.924 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.76 ' HB2' HD11 ' A' ' 7' ' ' LEU . 20.2 ttm180 -112.87 117.01 30.94 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.17 -0.468 . . . . 71.51 110.861 -179.977 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 31.3 mm -66.84 109.18 1.22 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.35 0 CA-C-N 116.206 -0.452 . . . . 74.5 111.129 179.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.566 HG23 ' HG2' ' A' ' 56' ' ' ARG . 3.5 pt -130.91 170.09 20.33 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.356 0 CA-C-N 116.18 -0.464 . . . . 74.41 111.18 179.825 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 31.9 t0 -114.41 141.24 47.91 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.197 -0.456 . . . . 62.04 110.846 179.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -66.29 -24.99 66.65 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.163 -0.471 . . . . 63.22 110.92 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -90.85 -28.98 17.8 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 74.13 110.87 179.844 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.6 t0 -148.73 73.6 10.47 Favored Pre-proline 0 C--N 1.328 -0.351 0 CA-C-O 121.59 0.709 . . . . 53.14 110.839 179.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.586 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.2 Cg_endo -69.79 -10.87 29.59 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.709 2.273 . . . . 70.41 112.331 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -91.69 -12.67 33.4 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 72.41 111.095 179.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 6.6 ttmm -74.44 -52.06 13.11 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.189 -0.459 . . . . 74.15 110.905 179.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.533 ' HA ' HG23 ' A' ' 69' ' ' VAL . 73.4 m-85 -98.38 23.11 8.81 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.249 -0.432 . . . . 71.14 110.926 -179.945 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.586 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -81.43 -21.97 38.51 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.108 -0.497 . . . . 65.41 111.08 179.904 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 2.2 t -96.96 -12.68 23.06 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.232 -0.44 . . . . 65.2 110.829 -179.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.533 HG23 ' HA ' ' A' ' 66' ' ' TYR . 55.4 t -51.44 141.73 4.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 63.02 111.157 179.949 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 31.1 m-20 -91.35 76.13 5.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.173 -0.467 . . . . 71.14 110.875 179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.577 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -47.51 -34.91 8.08 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.185 -0.462 . . . . 64.21 111.143 -179.864 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.2 t80 -60.17 -44.24 95.2 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.184 -0.462 . . . . 71.13 110.953 -179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 46.0 t0 -63.87 113.47 3.45 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.088 -0.506 . . . . 73.44 110.886 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.06 -24.13 37.84 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.194 -0.457 . . . . 73.44 110.866 -179.857 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -66.3 -57.4 7.6 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.183 -0.462 . . . . 64.51 110.895 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 4.0 mm-40 -57.61 -56.07 26.61 Favored 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.115 -0.493 . . . . 65.35 110.913 -179.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -53.41 -31.32 18.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.191 -0.459 . . . . 71.42 111.128 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 7.8 mtm -68.35 -55.54 11.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.136 -0.484 . . . . 73.44 110.863 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 48.2 mttt -54.53 -39.04 67.27 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.262 -0.426 . . . . 71.15 110.894 179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.479 HD11 HG11 ' A' ' 69' ' ' VAL . 70.4 mt -65.71 -58.22 7.69 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.243 -0.435 . . . . 65.1 111.079 179.905 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.731 HG23 ' HB ' ' A' ' 86' ' ' ILE . 97.8 mt -57.79 -35.17 50.15 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.148 -0.478 . . . . 72.3 111.127 179.879 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 25.2 t70 -70.77 -52.01 23.42 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.153 -0.476 . . . . 44.45 110.836 179.897 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 4.3 mt-10 -61.28 -49.4 77.21 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.208 -0.451 . . . . 74.31 110.892 -179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 11.7 m-85 -68.9 -14.5 63.07 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.163 -0.471 . . . . 74.51 110.881 -179.908 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 58.65 55.57 4.68 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.155 -0.475 . . . . 72.15 110.902 179.986 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.731 ' HB ' HG23 ' A' ' 81' ' ' ILE . 39.0 mt -84.9 132.07 47.11 Favored Pre-proline 0 C--N 1.328 -0.357 0 CA-C-O 121.671 0.748 . . . . 63.45 111.16 179.84 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 151.33 68.78 Favored 'Trans proline' 0 C--N 1.342 0.215 0 C-N-CA 122.634 2.223 . . . . 74.2 112.389 179.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -85.55 168.29 14.63 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.253 -0.43 . . . . 73.15 111.167 -179.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.619 HG23 ' O ' ' A' ' 31' ' ' HIS . 71.1 t -51.66 -58.12 2.6 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.252 -0.431 . . . . 63.04 111.108 179.947 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -52.02 -51.65 55.97 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.168 -0.469 . . . . 71.12 110.874 -179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 40.1 mm-40 -57.02 -41.07 77.88 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.156 -0.475 . . . . 45.4 110.878 -179.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.446 ' O ' HG23 ' A' ' 96' ' ' THR . 34.8 t90 -66.93 -38.02 85.41 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.251 -0.431 . . . . 73.22 110.932 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.6 mmpt? -68.12 -35.47 78.17 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.216 -0.447 . . . . 73.44 110.926 179.934 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 14.2 t70 -71.79 -49.85 35.09 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 61.54 110.912 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.407 ' HG2' ' HA ' ' A' ' 92' ' ' TRP . 21.0 pt20 -61.03 -39.93 91.67 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.205 -0.452 . . . . 63.42 110.891 -179.962 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.446 HG23 ' O ' ' A' ' 92' ' ' TRP . 38.8 p -70.9 -42.64 69.71 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 52.54 111.157 -179.95 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 1.1 mmm180 -62.2 -38.82 90.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 63.12 110.896 -179.958 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 59.4 mtp180 -80.61 -30.25 36.8 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.19 -0.459 . . . . 73.41 110.851 -179.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 16.4 t80 -78.32 -22.54 47.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.203 -0.453 . . . . 74.25 110.934 -179.859 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 11.7 mmmt -91.46 -23.7 19.92 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.09 -0.504 . . . . 71.02 110.896 179.92 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 18.8 pt-20 -89.25 9.43 25.88 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.21 -0.45 . . . . 63.33 110.917 -180.0 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 1.5 m 51.48 47.72 24.28 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.098 -0.501 . . . . 64.42 110.855 -179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 90.0 p -70.99 -169.02 0.32 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.144 -0.48 . . . . 72.34 110.881 -179.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.443 HG22 ' N ' ' A' ' 105' ' ' GLN . 9.5 mt -79.99 158.78 4.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.16 -0.473 . . . . 74.44 111.123 179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.443 ' N ' HG22 ' A' ' 104' ' ' ILE . 6.8 pt20 -49.69 166.7 0.05 Allowed 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.16 -0.473 . . . . 44.22 110.916 179.953 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.1 mp -119.34 -60.61 2.57 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.194 -0.457 . . . . 63.54 111.144 179.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -157.28 57.71 0.37 Allowed Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.741 -0.742 . . . . 73.05 112.494 179.902 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 23.3 m120 -88.77 122.26 31.99 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.88 0.371 . . . . 71.35 110.935 -179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 164.46 151.92 6.75 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.789 -0.72 . . . . 72.55 112.534 -179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 16.4 t-80 -172.79 154.76 3.03 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.775 0.321 . . . . 75.31 110.903 -179.963 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -102.13 -157.65 26.19 Favored Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.779 -0.724 . . . . 75.24 112.508 -179.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 3.6 tt0 -173.85 141.46 0.81 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.85 0.357 . . . . 72.03 110.898 -179.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 64.2 m -78.92 -176.05 4.82 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.183 -0.462 . . . . 75.11 110.865 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 14.8 tt0 -144.54 143.55 30.88 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.168 -0.469 . . . . 75.04 110.946 -179.953 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -131.84 115.79 1.75 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.718 -0.754 . . . . 74.32 112.512 -179.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -153.53 174.3 14.6 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.794 0.33 . . . . 73.24 110.867 -179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.8 tp10 . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 55.55 110.915 179.946 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.307 0 N-CA-C 112.455 -0.258 . . . . 43.43 112.455 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' -8' ' ' LYS . . . . . 0.639 ' C ' HD12 ' B' ' -6' ' ' ILE . 0.1 OUTLIER -156.29 175.58 13.81 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.766 0.317 . . . . 74.34 110.924 -179.966 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 59.82 26.33 15.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.243 -0.435 . . . . 72.35 110.863 179.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' -6' ' ' ILE . . . . . 0.639 HD12 ' C ' ' B' ' -8' ' ' LYS . 3.0 mp -78.26 116.47 59.28 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.608 0.718 . . . . 73.42 111.141 179.978 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 -49.58 0.55 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.679 2.253 . . . . 64.4 112.366 179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 1.2 t 49.61 32.36 4.93 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.187 -0.46 . . . . 72.31 110.877 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -116.31 162.56 25.69 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.598 0.713 . . . . 74.22 110.872 -179.961 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.68 -18.19 37.5 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.714 2.276 . . . . 73.11 112.355 179.988 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 65.92 146.15 0.1 OUTLIER Pre-proline 0 C--N 1.328 -0.332 0 CA-C-O 121.593 0.711 . . . . 70.13 111.08 179.88 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.79 153.49 68.72 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.674 2.249 . . . . 63.31 112.362 179.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 5.2 mtmp? -100.4 161.17 24.92 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.598 0.713 . . . . 60.3 110.894 179.907 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 165.31 31.38 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.664 2.243 . . . . 63.32 112.356 179.918 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 88.01 0.54 Allowed 'Trans proline' 0 C--N 1.341 0.14 0 C-N-CA 122.678 2.252 . . . . 73.45 112.321 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 1.3 m -113.06 74.15 0.85 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.188 -0.46 . . . . 63.31 110.838 -179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 77.8 p -82.66 -175.17 5.63 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.121 -0.49 . . . . 61.41 110.828 -179.812 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.277 0 CA-C-N 116.12 -0.491 . . . . 74.12 111.126 179.901 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.231 0.104 0 CA-C-O 120.797 0.332 . . . . 75.23 110.862 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . 0.593 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -136.97 160.44 66.17 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.518 0.675 . . . . 75.24 111.137 179.878 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.593 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.4 Cg_endo -69.82 126.61 13.47 Favored 'Trans proline' 0 C--O 1.231 0.155 0 C-N-CA 122.66 2.24 . . . . 74.53 112.366 -179.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.631 HD11 HD12 ' A' ' 28' ' ' ILE . 0.5 OUTLIER -118.36 156.28 29.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.195 -0.457 . . . . 72.53 110.939 -179.983 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 30.1 m-85 -130.15 150.65 51.32 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.2 -0.455 . . . . 72.45 110.866 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -135.04 144.86 47.51 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.154 -0.476 . . . . 41.14 111.102 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.67 HG23 ' O ' ' A' ' 24' ' ' GLU . 10.0 p -114.58 129.38 70.76 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.19 -0.459 . . . . 75.11 111.131 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.652 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -69.17 132.3 46.31 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.165 -0.47 . . . . 50.33 111.119 -179.997 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.753 HD11 ' HB2' ' A' ' 56' ' ' ARG . 3.8 mt -100.73 -20.94 15.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.201 -0.454 . . . . 74.22 110.918 179.949 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 42.1 m-85 -129.25 168.62 15.93 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.163 -0.472 . . . . 71.03 110.942 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 2.7 tt0 -88.91 104.89 17.37 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.145 -0.479 . . . . 73.22 110.899 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.409 ' HB3' HG12 ' A' ' 20' ' ' VAL . 16.7 t80 -91.46 104.42 16.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.193 -0.458 . . . . 72.04 110.886 -179.916 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.6 mmtp -84.96 106.44 16.47 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.167 -0.47 . . . . 71.12 110.909 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.24 158.74 3.91 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.225 -0.443 . . . . 41.02 111.116 179.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -128.49 -39.2 1.68 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.23 -0.441 . . . . 62.23 110.863 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 16.0 mmm180 -108.28 178.86 4.37 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.169 -0.469 . . . . 74.24 110.854 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 7.9 t70 -67.27 -36.38 81.46 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.193 -0.458 . . . . 63.53 110.833 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -68.76 -49.14 61.15 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.212 -0.449 . . . . 73.15 110.903 179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.4 tp10 -57.04 135.45 56.31 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.22 -0.445 . . . . 63.45 110.88 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 18' ' ' LEU . 11.0 tp -112.13 129.77 56.12 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.149 -0.478 . . . . 62.33 110.91 -179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -74.01 142.1 45.79 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.215 -0.448 . . . . 74.3 110.846 179.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.783 HG21 HD11 ' A' ' 26' ' ' LEU . 6.4 p -152.82 144.61 15.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.198 -0.456 . . . . 62.22 111.135 -179.989 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.3 m -105.47 160.52 25.77 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.668 0.746 . . . . 63.24 110.89 -179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 122.23 8.92 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.694 2.263 . . . . 72.44 112.38 179.962 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.09 5.53 30.53 Favored Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.765 -0.731 . . . . 70.12 112.473 179.965 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.67 ' O ' HG23 ' A' ' 5' ' ' VAL . 13.8 mt-10 -92.3 161.08 14.83 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.82 0.343 . . . . 74.43 110.91 -179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 8.1 m120 -107.83 127.03 53.35 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.195 -0.457 . . . . 75.22 110.894 -179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.783 HD11 HG21 ' A' ' 20' ' ' VAL . 2.1 mt -129.7 146.5 51.47 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.152 -0.476 . . . . 74.42 110.919 179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.7 t -104.86 112.54 25.69 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.225 -0.443 . . . . 60.14 110.887 -179.955 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.798 HG12 ' HB2' ' A' ' 39' ' ' ALA . 58.1 mt -81.92 145.41 8.75 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.128 -0.487 . . . . 73.1 111.147 179.953 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 80.8 m -117.27 -33.41 4.66 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 43.14 110.869 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -161.04 173.57 15.01 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 41.14 111.102 179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.426 ' ND1' HD13 ' A' ' 81' ' ' ILE . 1.5 p80 -122.84 177.95 5.25 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.212 -0.449 . . . . 73.21 110.845 -179.963 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 50.4 t80 -141.94 99.95 3.64 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 74.43 110.934 -179.874 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 26.3 t0 54.61 22.82 4.23 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.087 -0.506 . . . . 74.45 110.911 179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.625 ' HD2' HD12 ' A' ' 81' ' ' ILE . 37.1 m-85 63.74 15.42 8.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 63.24 110.925 -179.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 21.2 mm-40 -103.46 -40.89 6.17 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.07 -0.514 . . . . 65.0 110.897 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.418 ' CZ2' ' HB2' ' B' ' -3' ' ' ARG . 91.1 m95 -122.24 164.22 18.24 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.194 -0.457 . . . . 74.54 110.902 -179.95 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.755 ' CD2' HG22 ' A' ' 52' ' ' VAL . 1.3 m-85 -134.63 130.5 36.5 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 74.31 110.857 -179.987 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.562 HG13 HG22 ' A' ' 89' ' ' VAL . 8.5 mm -92.39 94.29 4.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.109 -0.496 . . . . 65.45 111.146 179.968 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.798 ' HB2' HG12 ' A' ' 28' ' ' ILE . . . -124.59 164.49 19.71 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.191 -0.459 . . . . 71.54 111.099 179.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 5.9 pttm -127.43 157.25 73.42 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.521 0.677 . . . . 64.32 110.926 179.942 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 138.12 37.2 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.683 2.256 . . . . 72.24 112.32 179.883 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 60.5 mt -106.17 -43.25 7.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.231 -0.44 . . . . 73.43 111.15 179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' A ASN . . . . . . . . . . . . . 18.0 t-20 -63.19 -50.7 69.28 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.205 -0.452 . . . . 64.23 110.879 179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' B ARG . . . . . . . . . . . . . 0.0 OUTLIER -105.25 -177.49 3.38 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.168 -0.469 . . . . 74.44 110.893 -179.969 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.405 HD23 ' HA ' ' A' ' 44' ' ' LEU . 9.6 mt -120.88 119.41 32.56 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.211 -0.449 . . . . 63.13 110.898 179.998 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -148.78 -52.26 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.751 -0.737 . . . . 33.21 112.481 179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 133.69 167.27 11.56 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.808 -0.71 . . . . 64.11 112.522 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 116.62 4.65 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.619 2.212 . . . . 63.01 112.363 -179.94 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -115.83 -130.71 4.72 Favored Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.702 -0.761 . . . . 73.24 112.487 179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.0 OUTLIER -144.18 127.05 16.31 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-O 120.861 0.363 . . . . 71.32 110.913 -179.913 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 6.2 p -135.13 129.85 19.09 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.672 0.749 . . . . 74.35 111.135 179.822 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.68 161.72 44.82 Favored 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.677 2.251 . . . . 65.2 112.346 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.755 HG22 ' CD2' ' A' ' 37' ' ' PHE . 4.0 t -83.06 -21.74 8.91 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.238 -0.437 . . . . 71.53 111.139 179.898 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 30.2 m -75.98 -4.7 42.58 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.124 -0.489 . . . . 74.25 110.888 -179.881 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 39.6 m-85 -126.16 -0.82 7.09 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.128 -0.487 . . . . 65.42 110.939 -179.903 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -125.37 147.87 29.98 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.144 -0.48 . . . . 73.14 111.133 179.924 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.753 ' HB2' HD11 ' A' ' 7' ' ' LEU . 15.7 ttp180 -123.63 110.6 15.2 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.171 -0.468 . . . . 73.43 110.814 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.406 ' O ' HG22 ' A' ' 57' ' ' ILE . 1.7 mp -65.76 111.44 1.53 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.175 -0.466 . . . . 74.45 111.146 179.938 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.654 HG23 ' HG2' ' A' ' 56' ' ' ARG . 3.5 pt -127.64 141.69 45.7 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-N 116.175 -0.466 . . . . 71.42 111.107 179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 28.8 t0 -70.43 123.83 22.73 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.182 -0.463 . . . . 74.33 110.895 179.819 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 24.0 tp -56.35 -24.93 47.36 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.215 -0.448 . . . . 74.31 110.92 -179.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.01 -29.38 16.63 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.211 -0.45 . . . . 64.35 110.878 179.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -143.09 78.49 15.14 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.618 0.723 . . . . 75.34 110.841 179.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.748 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.9 Cg_endo -69.76 -7.36 20.85 Favored 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.668 2.245 . . . . 73.31 112.339 179.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.11 -7.58 38.98 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.242 -0.435 . . . . 74.5 111.047 179.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.3 mtpt -84.4 -52.22 6.34 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.3 -0.409 . . . . 73.31 110.863 179.995 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.648 ' O ' HG12 ' A' ' 69' ' ' VAL . 12.9 m-85 -97.48 23.88 7.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.248 -0.433 . . . . 73.05 110.914 -179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.748 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -85.41 -19.2 31.71 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.153 -0.476 . . . . 74.04 111.118 179.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 90.4 p -92.58 -24.13 18.82 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.237 -0.438 . . . . 65.42 110.859 -179.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 1.054 HG21 HD11 ' A' ' 80' ' ' ILE . 9.0 p -52.07 155.56 0.57 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.333 0 CA-C-N 116.152 -0.477 . . . . 74.0 111.14 179.925 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 68.6 m-20 -110.61 94.98 5.28 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.195 -0.457 . . . . 75.03 110.871 179.933 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.742 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -58.44 -38.64 77.89 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 116.175 -0.466 . . . . 61.2 111.119 -179.867 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 9.8 t80 -55.1 -44.26 74.78 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.252 -0.431 . . . . 75.13 110.917 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 59.3 t0 -63.74 110.04 1.91 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.134 -0.485 . . . . 52.52 110.88 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.57 -28.69 21.98 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.197 -0.456 . . . . 62.53 110.878 -179.885 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.3 mt-10 -66.97 -56.74 8.88 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.159 -0.473 . . . . 72.14 110.892 -179.943 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -58.64 -55.15 38.83 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.175 -0.466 . . . . 74.11 110.89 -179.893 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.55 ' HA ' HD12 ' A' ' 80' ' ' ILE . 5.5 p -53.92 -33.22 23.46 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.193 -0.458 . . . . 75.23 111.09 -179.991 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 14.5 mtm -67.14 -53.5 30.03 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.231 -0.44 . . . . 72.23 110.834 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.1 mttm -56.18 -37.4 69.55 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.216 -0.447 . . . . 55.52 110.925 179.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 1.054 HD11 HG21 ' A' ' 69' ' ' VAL . 17.3 mt -66.77 -52.62 43.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.221 -0.445 . . . . 74.3 111.102 179.906 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.744 HG23 ' HB ' ' A' ' 86' ' ' ILE . 90.6 mt -63.25 -33.86 63.59 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.152 -0.476 . . . . 62.22 111.096 179.872 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -71.11 -46.2 62.16 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.191 -0.459 . . . . 71.0 110.885 179.897 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 58.6 mm-40 -68.53 -48.43 64.33 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.178 -0.465 . . . . 63.01 110.844 -179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 15.4 m-85 -68.75 -15.35 63.49 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.134 -0.485 . . . . 73.15 110.839 -179.861 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 45.7 mmtt 59.95 49.56 7.61 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.147 -0.479 . . . . 52.14 110.884 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.744 ' HB ' HG23 ' A' ' 81' ' ' ILE . 24.5 mt -78.23 131.53 68.94 Favored Pre-proline 0 C--N 1.328 -0.335 0 CA-C-O 121.598 0.714 . . . . 71.54 111.177 179.89 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 164.32 34.97 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.701 2.268 . . . . 72.35 112.307 179.91 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -95.41 170.2 9.53 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.2 -0.455 . . . . 75.53 111.19 179.956 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.562 HG22 HG13 ' A' ' 38' ' ' ILE . 68.6 t -55.81 -54.65 24.01 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.272 -0.422 . . . . 63.05 111.122 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -51.95 -50.58 60.92 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.181 -0.463 . . . . 60.13 110.893 179.992 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 60.6 mm-40 -57.74 -44.39 86.01 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.125 -0.489 . . . . 73.22 110.894 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 23.0 t90 -61.68 -43.0 99.69 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.208 -0.451 . . . . 73.21 110.921 -179.982 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 5.1 mmpt? -60.65 -53.25 59.74 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.229 -0.441 . . . . 65.22 110.884 179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -59.98 -37.82 80.74 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.232 -0.44 . . . . 74.35 110.904 179.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 -61.06 -53.03 62.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.141 -0.481 . . . . 73.21 110.904 -179.916 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -61.85 -43.24 99.24 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.225 -0.443 . . . . 53.12 111.15 -179.936 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 13.5 mtt180 -59.74 -60.96 3.0 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.45 . . . . 73.24 110.874 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 52.9 mtp180 -55.91 -36.92 68.22 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.232 -0.44 . . . . 74.23 110.856 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -61.4 -47.41 85.91 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.231 -0.44 . . . . 71.14 110.9 -179.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 8.4 mmmt -74.92 -25.07 58.64 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.155 -0.475 . . . . 62.5 110.9 179.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -60.74 167.83 2.57 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 61.32 110.897 179.955 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 3.0 p -91.72 169.06 11.02 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 74.31 110.868 -179.772 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 15.1 m -85.02 -167.89 2.0 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.137 -0.483 . . . . 41.53 110.881 -179.814 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.507 HG22 ' CD ' ' A' ' 105' ' ' GLN . 7.3 mt -83.92 160.23 3.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.169 -0.469 . . . . 72.22 111.127 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.507 ' CD ' HG22 ' A' ' 104' ' ' ILE . 8.8 pm0 -49.22 165.3 0.06 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.207 -0.452 . . . . 73.41 110.917 179.932 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 21.9 mm -115.56 -24.78 3.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.239 -0.437 . . . . 74.02 111.134 179.954 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -101.29 -140.27 11.15 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.772 -0.728 . . . . 72.14 112.487 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -112.84 117.55 32.45 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.923 0.392 . . . . 55.45 110.894 -179.893 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -82.0 143.59 23.25 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.709 -0.758 . . . . 75.45 112.457 -179.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 10.2 m-70 -78.78 177.74 8.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-O 120.877 0.37 . . . . 74.2 110.832 -179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -80.86 137.93 18.68 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.751 -0.738 . . . . 71.3 112.484 -179.964 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.7 pm0 -131.33 179.01 6.28 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.774 0.321 . . . . 54.34 110.902 -179.879 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 2.1 p -150.25 153.86 36.92 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.188 -0.46 . . . . 45.33 110.86 -179.8 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -133.1 173.26 11.62 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.157 -0.474 . . . . 60.44 110.913 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -85.45 90.73 1.66 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.748 -0.739 . . . . 25.43 112.508 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 19.5 mt -124.51 -73.9 0.63 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.814 0.34 . . . . 74.11 110.875 -179.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 . . . . . 0 C--N 1.33 -0.257 0 CA-C-N 116.165 -0.47 . . . . 50.4 110.823 180.0 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.34 0 N-CA-C 112.521 -0.232 . . . . 51.21 112.521 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -121.08 -38.88 2.76 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.811 0.339 . . . . 71.24 110.871 -179.94 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 86.1 m-85 -74.38 -74.73 0.18 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.216 -0.447 . . . . 71.3 110.948 179.956 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 26.8 mm 53.06 76.31 0.54 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.653 0.739 . . . . 65.14 111.163 179.959 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.67 78.42 0.98 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.704 2.269 . . . . 63.32 112.386 179.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 14.5 t -81.13 -0.52 40.52 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.223 -0.444 . . . . 54.31 110.824 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' -3' ' ' ARG . . . . . 0.418 ' HB2' ' CZ2' ' A' ' 36' ' ' TRP . 24.5 mmt180 -48.91 161.21 0.43 Allowed Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.575 0.702 . . . . 74.23 110.874 -179.911 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.8 -26.21 27.62 Favored 'Trans proline' 0 C--O 1.231 0.142 0 C-N-CA 122.677 2.251 . . . . 64.11 112.344 -179.994 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.29 85.84 0.15 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.591 0.71 . . . . 72.35 111.08 179.854 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 158.38 57.09 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.622 2.215 . . . . 75.53 112.367 179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -92.94 160.45 33.79 Favored Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.582 0.706 . . . . 75.12 110.894 179.962 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 167.48 24.34 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.674 2.25 . . . . 74.52 112.345 179.856 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 119.87 6.75 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.645 2.23 . . . . 62.11 112.37 179.95 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 17.3 m -62.8 162.65 10.61 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.219 -0.446 . . . . 53.42 110.871 -179.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 7.8 t -127.59 -45.62 1.47 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.153 -0.476 . . . . 75.44 110.865 -179.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.125 -0.489 . . . . 71.1 111.094 179.909 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 21.3 ptm . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.783 0.325 . . . . 74.03 110.864 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . 0.564 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -149.22 159.84 36.07 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.657 0.741 . . . . 54.03 111.072 179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.564 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.9 Cg_endo -69.79 78.42 1.02 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.694 2.263 . . . . 74.03 112.332 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.697 HD11 HG13 ' A' ' 28' ' ' ILE . 0.4 OUTLIER -90.98 145.45 24.7 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.195 -0.457 . . . . 74.0 110.937 179.943 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 11.1 m-85 -123.26 142.84 50.51 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.466 . . . . 70.33 110.875 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -122.76 150.49 42.71 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.135 -0.484 . . . . 70.42 111.057 179.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.1 p -116.07 129.08 73.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.176 -0.465 . . . . 65.2 111.127 179.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.707 HG21 ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -68.39 132.46 47.09 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.202 -0.453 . . . . 63.44 111.153 -179.957 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.779 HD11 ' HB2' ' A' ' 56' ' ' ARG . 7.1 mt -102.71 -16.81 15.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.208 -0.451 . . . . 64.42 110.909 -179.99 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 35.7 m-85 -136.49 161.99 34.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.158 -0.474 . . . . 64.45 110.924 179.956 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.1 tp10 -86.87 114.26 23.37 Favored 'General case' 0 C--N 1.331 -0.232 0 CA-C-N 116.086 -0.506 . . . . 61.52 110.865 -179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 21.3 t80 -100.2 130.08 46.29 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.115 -0.493 . . . . 73.23 110.88 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 15.4 mttt -104.21 109.36 21.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.12 -0.491 . . . . 65.11 110.913 179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.478 ' HB1' ' HB3' ' A' ' 17' ' ' GLU . . . -62.86 159.58 16.39 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.238 -0.437 . . . . 71.31 111.114 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -116.57 -28.44 6.42 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.223 -0.444 . . . . 74.24 110.89 -179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 24.2 mmm180 -141.46 -174.52 4.06 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.161 -0.472 . . . . 74.3 110.846 -179.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.3 m-20 -64.71 -39.19 93.23 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.172 -0.467 . . . . 73.43 110.824 179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -62.86 -18.4 62.86 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.222 -0.445 . . . . 71.21 110.85 -179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.478 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 0.4 OUTLIER -110.2 140.12 44.65 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.203 -0.453 . . . . 73.33 110.912 -179.904 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.434 ' C ' ' HB2' ' A' ' 12' ' ' ALA . 4.6 tp -114.57 153.77 29.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.203 -0.453 . . . . 74.44 110.898 -179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -97.78 126.77 43.3 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.476 . . . . 62.34 110.864 179.821 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.707 ' HB ' HG21 ' A' ' 6' ' ' THR . 0.2 OUTLIER -125.51 159.29 33.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.246 -0.433 . . . . 72.21 111.16 179.955 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.4 m -124.27 159.25 58.01 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.654 0.74 . . . . 45.44 110.799 -179.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 118.48 5.71 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.656 2.238 . . . . 73.22 112.329 179.964 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.02 -0.34 31.6 Favored Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.758 -0.734 . . . . 63.25 112.504 179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -89.25 151.37 22.17 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-O 120.863 0.363 . . . . 74.44 110.888 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.568 ' CB ' HD12 ' A' ' 42' ' ' ILE . 10.5 m120 -96.61 112.63 24.3 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.136 -0.483 . . . . 65.43 110.881 -179.91 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.754 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 3.1 mm? -112.25 142.04 45.22 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.193 -0.458 . . . . 64.21 110.905 179.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -95.72 112.48 24.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 60.44 110.85 -179.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.697 HG13 HD11 ' A' ' 2' ' ' LEU . 31.3 mm -66.94 144.89 14.23 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.122 -0.49 . . . . 71.42 111.117 179.982 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 51.5 m -122.46 -42.09 2.36 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.169 -0.469 . . . . 62.14 110.904 179.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.409 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -171.77 168.97 6.02 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.194 -0.457 . . . . 62.54 111.117 179.974 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.442 ' CE1' HG21 ' A' ' 81' ' ' ILE . 2.1 p80 -119.45 178.31 4.59 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.236 -0.438 . . . . 65.43 110.861 179.989 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 37.1 t80 -148.69 105.7 3.6 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.177 -0.465 . . . . 65.14 110.854 -179.838 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 56.54 22.52 6.68 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.084 -0.507 . . . . 74.31 110.866 179.891 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.614 ' HD2' HD12 ' A' ' 81' ' ' ILE . 16.5 m-85 57.78 22.78 8.87 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.171 -0.468 . . . . 72.54 110.939 -179.796 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.8 pt-20 -121.06 -5.47 9.52 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.119 -0.491 . . . . 70.23 110.935 179.963 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.555 ' HB3' HD11 ' A' ' 49' ' ' LEU . 98.7 m95 -152.51 158.8 43.06 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.11 -0.495 . . . . 74.11 110.89 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.601 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.5 OUTLIER -141.55 151.67 43.43 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.458 . . . . 71.12 110.888 -179.972 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.42 ' CD1' HD22 ' A' ' 49' ' ' LEU . 6.3 mm -109.49 94.03 2.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.191 -0.459 . . . . 71.12 111.121 179.977 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.754 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -107.25 146.03 31.95 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.178 -0.465 . . . . 75.24 111.159 179.78 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -118.0 155.56 51.07 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.584 0.706 . . . . 64.52 110.93 179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 123.7 10.35 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.66 2.24 . . . . 73.22 112.329 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.568 HD12 ' CB ' ' A' ' 25' ' ' ASN . 69.5 mt -78.04 -46.23 26.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 70.24 111.123 179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' A ASN . . . . . . . . . . . . . 15.7 m120 -60.72 -70.49 0.17 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.15 -0.477 . . . . 64.02 110.914 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' B ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.04 -173.53 3.9 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.135 -0.484 . . . . 72.23 110.863 -179.97 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -106.43 -74.75 0.65 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.191 -0.459 . . . . 64.15 110.903 -179.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 57.85 -97.92 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.304 0 C-N-CA 120.697 -0.763 . . . . 64.2 112.484 179.891 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 177.49 164.06 30.4 Favored Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.758 -0.734 . . . . 54.23 112.491 -179.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 140.92 43.89 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.692 2.262 . . . . 54.01 112.365 -179.992 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -129.71 -146.44 6.04 Favored Glycine 0 N--CA 1.451 -0.305 0 C-N-CA 120.739 -0.743 . . . . 53.22 112.477 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.555 HD11 ' HB3' ' A' ' 36' ' ' TRP . 0.1 OUTLIER -137.04 124.75 22.4 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.828 0.347 . . . . 64.13 110.889 -179.932 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.424 ' N ' HD13 ' A' ' 49' ' ' LEU . 14.5 p -134.26 132.25 21.0 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.636 0.731 . . . . 71.33 111.109 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.665 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.6 Cg_endo -69.8 158.36 57.19 Favored 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.677 2.251 . . . . 53.5 112.328 179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.922 HG11 HG21 ' A' ' 77' ' ' VAL . 2.7 t -76.3 -20.86 15.2 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.251 0 CA-C-N 116.204 -0.453 . . . . 75.41 111.128 179.951 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 66.4 m -79.71 0.95 28.35 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 73.44 110.856 -179.856 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.407 ' HB2' ' HG2' ' A' ' 51' ' ' PRO . 7.5 m-85 -118.75 -27.13 5.91 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.145 -0.48 . . . . 75.41 110.959 -179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.665 HG22 ' O ' ' A' ' 51' ' ' PRO . 13.1 m -106.23 147.9 11.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.276 0 CA-C-N 116.081 -0.508 . . . . 43.44 111.123 179.941 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.779 ' HB2' HD11 ' A' ' 7' ' ' LEU . 15.4 ttp180 -117.66 110.9 18.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.192 -0.458 . . . . 55.2 110.874 -179.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.42 ' O ' HG22 ' A' ' 57' ' ' ILE . 1.6 mp -68.76 112.39 3.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.153 -0.476 . . . . 53.4 111.125 179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.66 HG23 ' HG2' ' A' ' 56' ' ' ARG . 7.1 pt -125.22 167.16 19.79 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.2 -0.455 . . . . 74.25 111.171 179.844 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -102.42 125.39 49.12 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.203 -0.453 . . . . 62.21 110.895 179.859 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 9.3 mt -56.22 -24.7 43.78 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.172 -0.467 . . . . 63.24 110.951 -179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -89.75 -29.92 18.37 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.15 -0.477 . . . . 73.14 110.856 179.87 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -145.92 74.74 13.27 Favored Pre-proline 0 C--N 1.328 -0.337 0 CA-C-O 121.596 0.712 . . . . 63.44 110.898 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.669 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.4 Cg_endo -69.76 -8.83 24.61 Favored 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.711 2.274 . . . . 73.41 112.359 -179.953 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.96 -5.9 36.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 54.43 111.078 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 7.2 ttmm -84.1 -51.97 6.65 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.212 -0.449 . . . . 73.34 110.884 179.954 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . . . . . . . . . 70.5 m-85 -90.67 -0.08 57.57 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.222 -0.444 . . . . 75.52 110.895 -179.918 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.669 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -61.3 -17.86 55.71 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.122 -0.49 . . . . 62.03 111.12 179.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 86.2 p -76.62 -24.16 53.39 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.25 -0.432 . . . . 52.53 110.817 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.7 HG12 ' H ' ' A' ' 71' ' ' THR . 14.2 t -77.77 121.76 31.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.149 -0.478 . . . . 74.24 111.11 179.969 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 6.8 m-20 -90.25 11.68 20.46 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.203 -0.453 . . . . 65.35 110.835 179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.858 ' HB ' HG12 ' A' ' 52' ' ' VAL . 2.0 p 45.91 33.7 1.69 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.165 -0.471 . . . . 75.52 111.163 -179.883 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 15.3 t80 -104.12 -54.83 2.47 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.199 -0.455 . . . . 73.05 110.951 -179.935 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -63.86 115.44 4.84 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.124 -0.489 . . . . 75.02 110.812 179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.04 -28.99 19.19 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.457 . . . . 73.03 110.896 -179.934 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 20.5 mt-10 -66.61 -49.04 67.61 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.159 -0.473 . . . . 74.0 110.909 -179.93 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 31.1 mt-30 -62.95 -57.0 12.27 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.127 -0.488 . . . . 74.51 110.961 -179.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.922 HG21 HG11 ' A' ' 52' ' ' VAL . 1.7 p -54.31 -31.7 22.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.288 0 CA-C-N 116.19 -0.459 . . . . 63.14 111.162 179.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 11.5 mtm -67.91 -54.11 21.3 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.119 -0.492 . . . . 63.44 110.844 179.932 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 34.8 mttt -57.55 -35.79 70.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.239 -0.437 . . . . 73.35 110.901 179.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.516 HD11 HG11 ' A' ' 69' ' ' VAL . 41.8 mt -67.71 -50.47 60.28 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.223 -0.444 . . . . 71.14 111.118 179.86 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.725 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.4 mt -65.64 -35.7 75.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.195 -0.457 . . . . 65.41 111.084 179.865 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -71.21 -52.05 21.24 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.197 -0.456 . . . . 72.3 110.886 179.89 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 64.6 mm-40 -58.57 -52.69 64.59 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.185 -0.461 . . . . 73.32 110.923 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -67.95 -15.51 63.64 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.143 -0.48 . . . . 72.1 110.885 -179.889 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.8 mmtm 60.94 54.98 3.26 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.486 . . . . 53.42 110.942 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.725 ' HB ' HG23 ' A' ' 81' ' ' ILE . 21.2 mt -82.25 131.3 56.52 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.622 0.725 . . . . 63.11 111.129 179.894 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.409 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 54.5 Cg_endo -69.72 162.81 40.59 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.654 2.236 . . . . 73.23 112.346 179.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -99.19 171.48 7.98 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.196 -0.456 . . . . 64.04 111.13 -179.973 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 85.8 t -51.94 -53.98 15.49 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.203 -0.453 . . . . 61.41 111.148 179.949 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 69.2 mt-10 -51.68 -51.99 51.65 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.2 -0.454 . . . . 73.52 110.853 179.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 60.4 mm-40 -59.21 -43.88 92.28 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.22 -0.446 . . . . 44.42 110.939 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 32.9 t90 -62.61 -38.75 91.41 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.182 -0.463 . . . . 71.51 110.893 -179.97 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 5.8 mmpt? -64.95 -52.8 54.33 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.221 -0.445 . . . . 63.32 110.867 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -58.23 -41.92 85.18 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.234 -0.439 . . . . 71.31 110.879 179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 23.3 mm-40 -63.09 -46.44 87.35 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.225 -0.443 . . . . 65.45 110.947 -179.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 2.1 p -64.58 -33.41 75.85 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.209 -0.451 . . . . 71.31 111.152 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 4.4 mmp_? -69.99 -63.95 0.98 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.217 -0.447 . . . . 74.12 110.877 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -53.77 -38.99 65.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.155 -0.475 . . . . 75.24 110.9 -179.937 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 43.1 t80 -65.66 -52.87 48.34 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 116.194 -0.457 . . . . 62.21 110.908 -179.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.46 -25.3 65.91 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.16 -0.473 . . . . 44.44 110.93 179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -86.33 179.29 6.92 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.194 -0.457 . . . . 75.31 110.903 179.928 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 17.2 m -96.24 179.16 5.14 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 74.04 110.856 -179.79 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 9.6 m -115.37 -170.56 1.79 Allowed 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.105 -0.498 . . . . 72.0 110.845 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 27.7 mm -69.97 150.61 10.01 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.137 -0.483 . . . . 72.34 111.099 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 7.9 pt20 -173.82 -176.43 1.22 Allowed 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.17 -0.468 . . . . 74.44 110.901 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 28.7 mm -96.8 98.18 7.26 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.196 -0.457 . . . . 64.41 111.155 179.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 171.77 121.67 0.61 Allowed Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.752 -0.737 . . . . 22.35 112.457 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 24.0 m120 -52.1 134.8 32.35 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-O 120.853 0.358 . . . . 61.14 110.902 -179.895 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 169.99 44.03 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.693 -0.765 . . . . 75.44 112.493 -179.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 31.7 t-80 -144.89 163.66 33.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-O 120.841 0.353 . . . . 53.31 110.887 -179.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -145.9 -159.99 8.45 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.772 -0.728 . . . . 53.11 112.498 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -157.69 145.0 18.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.776 0.322 . . . . 73.12 110.946 -179.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 4.7 p -72.34 179.83 3.24 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.23 -0.441 . . . . 73.03 110.833 -179.744 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 2.0 tp-100 -74.42 -56.95 4.28 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.159 -0.473 . . . . 72.3 110.93 -179.983 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 107.3 92.11 2.24 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.718 -0.753 . . . . 75.14 112.514 -179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -110.85 61.08 0.61 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.766 0.317 . . . . 53.15 110.921 -179.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.181 -0.463 . . . . 71.31 110.871 179.94 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' -9' ' ' GLY . . . . . 0.52 ' CA ' HD11 ' B' ' -6' ' ' ILE . . . . . . . . 0 N--CA 1.451 -0.314 0 N-CA-C 112.498 -0.241 . . . . 74.33 112.498 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 14.4 ttpp -95.09 -65.97 0.94 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.753 0.311 . . . . 55.42 110.91 179.974 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 62.6 m-85 -54.64 -74.72 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.202 -0.454 . . . . 64.31 110.857 179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' -6' ' ' ILE . . . . . 0.52 HD11 ' CA ' ' B' ' -9' ' ' GLY . 22.0 mm 56.48 77.88 0.4 Allowed Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.663 0.744 . . . . 63.23 111.16 -179.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.82 86.9 0.57 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.635 2.223 . . . . 73.25 112.365 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 13.2 t -80.4 -1.39 41.15 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.196 -0.456 . . . . 75.53 110.862 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' -3' ' ' ARG . . . . . 0.406 ' HB2' ' CZ2' ' A' ' 36' ' ' TRP . 0.0 OUTLIER -49.92 163.2 0.43 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.628 0.727 . . . . 74.25 110.85 -179.96 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 -22.64 31.87 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.686 2.258 . . . . 74.34 112.385 179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.63 84.07 0.19 Allowed Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.577 0.703 . . . . 74.2 111.135 179.899 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 163.24 38.97 Favored 'Trans proline' 0 C--O 1.232 0.197 0 C-N-CA 122.721 2.28 . . . . 74.31 112.368 -179.973 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 3.9 mptp? -100.14 160.47 27.02 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.601 0.715 . . . . 62.23 110.879 179.906 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 163.84 36.77 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.691 2.261 . . . . 51.41 112.339 179.903 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -32.18 19.06 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.702 2.268 . . . . 61.13 112.319 179.94 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 1.3 m 56.67 27.39 12.52 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.194 -0.457 . . . . 75.23 110.862 -179.817 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 13.1 t -108.94 134.08 52.08 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.111 -0.495 . . . . 72.24 110.872 -179.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.309 0 CA-C-N 116.169 -0.469 . . . . 70.22 111.095 179.902 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 4.0 ppp? . . . . . 0 C--O 1.231 0.109 0 CA-C-O 120.764 0.316 . . . . 64.43 110.914 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . 0.587 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -136.78 160.38 66.62 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.553 0.692 . . . . 60.13 111.124 179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.587 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 54.0 Cg_endo -69.73 83.53 0.69 Allowed 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.683 2.255 . . . . 52.42 112.367 -179.989 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -80.85 147.71 30.28 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.237 -0.438 . . . . 74.03 110.913 179.962 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.724 ' CE1' HD12 ' A' ' 60' ' ' LEU . 12.7 m-85 -116.8 163.9 15.47 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.169 -0.469 . . . . 65.1 110.93 179.912 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -142.91 164.02 31.21 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.159 -0.473 . . . . 72.22 111.099 179.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.531 HG23 ' O ' ' A' ' 24' ' ' GLU . 10.9 p -130.71 130.89 64.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.235 -0.439 . . . . 61.02 111.143 179.988 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.606 HG21 ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -72.86 139.6 47.03 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 74.44 111.09 -179.931 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.683 HD11 ' HB2' ' A' ' 56' ' ' ARG . 23.3 mt -114.07 -11.22 12.74 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 64.32 110.915 179.903 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 40.6 m-85 -137.01 159.63 41.31 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.216 -0.447 . . . . 71.31 110.892 -179.979 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -85.74 108.85 18.25 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.113 -0.494 . . . . 75.53 110.871 -179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -93.63 139.28 30.97 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 75.25 110.855 -179.939 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 1.8 mptt -112.97 97.1 6.31 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.118 -0.492 . . . . 54.43 110.927 179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -51.67 157.36 1.15 Allowed 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.209 -0.451 . . . . 72.12 111.108 179.832 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.5 pt-20 -115.82 -32.97 5.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.201 -0.454 . . . . 70.4 110.894 -179.973 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.6 mmp_? -133.11 -178.45 4.98 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.168 -0.469 . . . . 72.32 110.886 -179.896 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 6.4 t0 -63.47 -41.34 98.61 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.207 -0.451 . . . . 71.11 110.832 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.2 p30 -57.32 -23.68 50.22 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.211 -0.45 . . . . 63.03 110.901 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -98.0 152.23 19.49 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.15 -0.477 . . . . 55.13 110.908 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.676 HD13 ' O ' ' A' ' 46' ' ' GLY . 1.2 tt -131.77 120.55 22.83 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.138 -0.483 . . . . 64.34 110.945 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -63.73 143.62 57.69 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.235 -0.439 . . . . 74.54 110.836 179.883 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.606 ' HB ' HG21 ' A' ' 6' ' ' THR . 0.9 OUTLIER -139.95 159.11 26.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.195 -0.457 . . . . 72.33 111.144 -179.984 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.3 m -121.44 158.07 54.57 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.671 0.748 . . . . 73.21 110.861 -179.842 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.7 Cg_endo -69.72 117.96 5.39 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.709 2.273 . . . . 74.33 112.375 179.942 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.06 4.66 31.14 Favored Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.737 -0.744 . . . . 55.04 112.448 179.98 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.531 ' O ' HG23 ' A' ' 5' ' ' VAL . 39.5 mm-40 -92.12 154.59 18.61 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.85 0.357 . . . . 74.44 110.869 -179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 5.1 m120 -105.61 115.82 30.89 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.142 -0.481 . . . . 63.34 110.92 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.731 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 3.7 mp -116.55 155.35 28.84 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.201 -0.454 . . . . 62.45 110.938 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.5 t -108.26 112.79 25.45 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.206 -0.452 . . . . 73.04 110.895 -179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 57.4 mt -75.72 144.86 11.45 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 64.0 111.146 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.8 m -116.23 -43.94 2.92 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.144 -0.48 . . . . 72.41 110.924 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.52 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -161.02 174.8 13.23 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.162 -0.472 . . . . 54.31 111.115 179.995 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.439 ' CE1' HG21 ' A' ' 81' ' ' ILE . 3.3 p80 -121.18 177.95 4.95 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.191 -0.459 . . . . 75.52 110.829 -179.959 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.431 ' HB3' ' HB2' ' A' ' 36' ' ' TRP . 20.2 t80 -146.87 100.83 3.37 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.206 -0.452 . . . . 71.42 110.91 -179.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.416 ' HB3' ' HG2' ' A' ' 35' ' ' GLU . 33.6 t0 59.97 17.5 6.7 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.098 -0.501 . . . . 64.22 110.905 179.957 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.575 ' HD2' HD12 ' A' ' 81' ' ' ILE . 41.3 m-85 63.47 29.65 15.4 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.169 -0.469 . . . . 72.3 110.939 -179.809 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.416 ' HG2' ' HB3' ' A' ' 33' ' ' ASP . 4.4 pt-20 -131.16 -1.76 4.02 Favored 'General case' 0 C--N 1.33 -0.249 0 CA-C-N 116.101 -0.499 . . . . 64.54 110.921 179.996 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.448 ' HB3' HD21 ' A' ' 49' ' ' LEU . 88.1 m95 -152.73 135.52 15.41 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.107 -0.497 . . . . 74.14 110.905 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.581 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.5 OUTLIER -121.78 131.38 54.03 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.259 -0.428 . . . . 75.12 110.871 -179.951 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.4 mm -87.04 94.55 4.52 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.141 -0.481 . . . . 71.35 111.154 179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.731 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -111.1 138.99 46.85 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.204 -0.453 . . . . 74.43 111.106 179.847 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 51.2 pttt -112.82 153.67 45.07 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.55 0.69 . . . . 72.32 110.903 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 119.56 6.49 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.664 2.243 . . . . 65.3 112.394 179.878 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 64.4 mt -78.07 -19.54 13.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 72.24 111.16 179.911 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' A ASN . . . . . . . . . . . . . 7.0 t30 -68.26 -55.83 10.78 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.155 -0.475 . . . . 65.22 110.936 179.926 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' B ARG . . . . . . . . . . . . . 8.0 ptm180 -83.6 -171.3 3.51 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 75.31 110.832 -179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 12.0 mt -51.68 -75.13 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.172 -0.467 . . . . 73.11 110.928 -179.943 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 177.53 91.3 0.08 OUTLIER Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.768 -0.729 . . . . 25.3 112.492 179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.676 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -111.62 80.55 0.27 Allowed Glycine 0 N--CA 1.451 -0.342 0 C-N-CA 120.71 -0.757 . . . . 64.2 112.485 -179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.74 105.22 1.44 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.697 2.265 . . . . 73.44 112.348 -179.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -105.6 -106.47 3.12 Favored Glycine 0 N--CA 1.451 -0.309 0 C-N-CA 120.752 -0.737 . . . . 72.51 112.455 179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.448 HD21 ' HB3' ' A' ' 36' ' ' TRP . 1.3 tt -163.55 124.73 2.34 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-O 120.837 0.351 . . . . 72.25 110.935 -179.908 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.453 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.3 p -137.56 133.8 18.15 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.658 0.742 . . . . 72.23 111.074 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.453 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.9 Cg_endo -69.78 153.85 68.36 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.661 2.241 . . . . 75.02 112.355 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.822 HG12 ' HB ' ' A' ' 71' ' ' THR . 4.9 t -72.59 -21.01 19.67 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 64.32 111.148 179.918 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 16.0 m -77.0 -2.58 34.64 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.175 -0.466 . . . . 71.11 110.837 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.441 ' O ' HG22 ' A' ' 6' ' ' THR . 37.7 m-85 -127.22 22.8 6.54 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.107 -0.497 . . . . 64.3 110.881 -179.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.616 HG22 ' HA ' ' A' ' 52' ' ' VAL . 10.7 m -148.63 163.23 5.22 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.119 -0.491 . . . . 72.22 111.155 179.922 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.686 ' HG2' HG23 ' A' ' 58' ' ' ILE . 26.1 ttm180 -130.57 119.09 21.99 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.185 -0.461 . . . . 73.43 110.883 -179.977 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 43.2 mm -70.13 108.8 2.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.307 0 CA-C-N 116.198 -0.456 . . . . 72.54 111.152 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.686 HG23 ' HG2' ' A' ' 56' ' ' ARG . 1.4 pt -134.18 132.82 55.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.192 -0.458 . . . . 73.12 111.15 179.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 14.1 t0 -67.34 145.77 54.76 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.207 -0.451 . . . . 63.32 110.868 179.843 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.724 HD12 ' CE1' ' A' ' 3' ' ' PHE . 0.4 OUTLIER -71.31 -36.67 71.68 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.158 -0.474 . . . . 73.12 110.911 -179.954 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -83.24 -24.49 32.3 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.19 -0.459 . . . . 74.31 110.898 179.826 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.9 t0 -148.76 74.17 10.34 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.607 0.717 . . . . 62.11 110.904 179.974 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.677 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.7 Cg_endo -69.74 -8.57 23.95 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.688 2.259 . . . . 62.43 112.331 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.46 -18.46 23.19 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.209 -0.45 . . . . 72.55 111.113 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 21.8 ttmt -74.62 -50.32 18.25 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.213 -0.449 . . . . 73.12 110.921 179.963 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.536 ' O ' HG12 ' A' ' 69' ' ' VAL . 65.5 m-85 -95.25 23.27 5.95 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 75.31 110.939 -179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.677 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -89.48 11.71 18.62 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.13 -0.486 . . . . 53.53 111.11 179.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 49.7 p -114.87 -24.04 8.85 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.184 -0.462 . . . . 72.52 110.869 -179.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.536 HG12 ' O ' ' A' ' 66' ' ' TYR . 7.9 p -55.18 140.24 13.29 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.145 -0.48 . . . . 54.01 111.134 179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . 0.407 ' H ' ' NE2' ' A' ' 76' ' ' GLN . 31.4 m-20 -99.44 93.72 6.04 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.161 -0.472 . . . . 72.43 110.887 179.887 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.822 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -50.84 -30.15 13.64 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.173 -0.467 . . . . 70.41 111.127 -179.884 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -57.38 -51.02 71.1 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.236 -0.438 . . . . 72.42 110.876 -179.87 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 17.1 t0 -63.99 110.11 2.02 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.172 -0.467 . . . . 70.32 110.824 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.09 -24.29 39.33 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.202 -0.454 . . . . 74.45 110.865 -179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.2 mt-10 -66.87 -52.96 37.22 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-N 116.173 -0.467 . . . . 74.32 110.858 -179.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.602 ' O ' HD12 ' A' ' 80' ' ' ILE . 4.4 mt-30 -60.15 -58.45 8.49 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.186 -0.461 . . . . 75.01 110.943 -179.945 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.519 HG21 HG11 ' A' ' 52' ' ' VAL . 2.6 p -51.63 -32.27 13.67 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.228 -0.442 . . . . 73.35 111.162 179.949 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.8 mtm -68.16 -51.73 42.6 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 70.04 110.93 179.855 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 26.1 mttm -55.39 -47.07 76.42 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.209 -0.451 . . . . 74.22 110.94 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.602 HD12 ' O ' ' A' ' 76' ' ' GLN . 1.7 mp -60.98 -53.73 45.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 71.32 111.153 179.84 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.575 HD12 ' HD2' ' A' ' 34' ' ' TYR . 82.0 mt -57.35 -36.05 51.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.154 -0.476 . . . . 51.54 111.138 179.859 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 8.8 t70 -71.16 -51.9 22.25 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.174 -0.466 . . . . 75.51 110.883 179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -59.14 -49.4 78.03 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.22 -0.445 . . . . 74.33 110.924 -179.946 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.5 m-85 -67.9 -15.88 63.82 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.125 -0.489 . . . . 75.55 110.868 -179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 29.6 mmtm 61.31 49.51 5.34 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.139 -0.482 . . . . 75.43 110.873 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.565 ' HB ' HG23 ' A' ' 81' ' ' ILE . 38.2 mt -79.14 125.16 84.04 Favored Pre-proline 0 C--N 1.328 -0.344 0 CA-C-O 121.598 0.714 . . . . 61.23 111.158 179.834 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.52 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 54.0 Cg_endo -69.68 168.72 20.63 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.699 2.266 . . . . 63.4 112.342 179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -87.77 167.04 14.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.191 -0.459 . . . . 42.45 111.125 -179.997 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.689 HG12 ' CE ' ' A' ' 93' ' ' LYS . 96.2 t -51.04 -58.88 1.5 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.205 -0.452 . . . . 74.43 111.139 179.906 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 28.1 mt-10 -51.28 -48.04 62.35 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.141 -0.481 . . . . 73.05 110.877 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 2.3 mp0 -56.8 -33.48 66.72 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.176 -0.465 . . . . 75.42 110.886 -179.873 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 22.3 t90 -66.78 -41.01 88.36 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.241 -0.436 . . . . 75.01 110.888 -179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.689 ' CE ' HG12 ' A' ' 89' ' ' VAL . 16.7 mtmt -67.4 -49.32 64.36 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.25 -0.432 . . . . 73.24 110.915 179.939 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 35.8 t70 -61.6 -39.7 92.14 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.227 -0.442 . . . . 55.14 110.836 179.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 14.4 mm100 -65.27 -48.84 71.82 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.171 -0.468 . . . . 72.51 110.937 -179.933 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 3.6 p -63.19 -33.78 76.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.16 -0.473 . . . . 75.01 111.141 -179.958 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 10.2 mtm180 -68.18 -58.28 4.69 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.216 -0.447 . . . . 75.14 110.886 -180.0 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -63.17 -25.15 68.21 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 70.42 110.903 -179.93 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 76.7 t80 -83.29 -30.15 27.79 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.162 -0.472 . . . . 74.44 110.945 -179.846 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 16.1 mtpt -83.63 -17.14 42.57 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.112 -0.494 . . . . 65.52 110.946 179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -51.34 165.98 0.13 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 44.15 110.856 179.977 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.5 p -76.9 92.07 3.62 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.115 -0.493 . . . . 60.44 110.877 -179.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 39.1 m -149.15 -171.81 3.97 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.122 -0.49 . . . . 62.41 110.883 -179.818 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 30.0 mm -64.49 138.22 23.49 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.167 -0.47 . . . . 75.5 111.132 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -178.14 171.85 1.65 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.137 -0.483 . . . . 72.51 110.927 179.966 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.511 HD13 ' H ' ' A' ' 106' ' ' ILE . 0.1 OUTLIER -142.41 174.33 5.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.183 -0.462 . . . . 65.42 111.117 179.989 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 107.16 84.25 1.67 Allowed Glycine 0 N--CA 1.451 -0.301 0 C-N-CA 120.726 -0.75 . . . . 74.43 112.47 179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 32.2 m120 -73.24 123.7 24.2 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.917 0.389 . . . . 64.5 110.905 -179.918 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 165.96 98.03 0.12 Allowed Glycine 0 N--CA 1.451 -0.354 0 C-N-CA 120.766 -0.731 . . . . 74.03 112.497 179.97 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -125.73 162.52 24.87 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.848 0.356 . . . . 65.43 110.866 -179.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -167.14 179.0 41.08 Favored Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.729 -0.748 . . . . 72.14 112.541 -179.983 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 14.3 pt20 -151.59 166.01 32.52 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-O 120.85 0.357 . . . . 73.45 110.88 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.1 p -155.05 144.23 21.03 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.161 -0.472 . . . . 64.33 110.855 -179.763 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -68.63 138.63 55.18 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.111 -0.495 . . . . 73.12 110.9 -179.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -129.58 91.37 0.31 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.694 -0.765 . . . . 72.51 112.453 -179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -127.86 -39.16 1.8 Allowed 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.795 0.331 . . . . 54.45 110.915 -179.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 . . . . . 0 C--N 1.33 -0.271 0 CA-C-N 116.201 -0.454 . . . . 64.21 110.887 179.925 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.311 0 N-CA-C 112.496 -0.241 . . . . 72.24 112.496 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 32.6 mtpt -95.06 -38.78 10.48 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.8 0.334 . . . . 64.42 110.941 179.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -88.93 -76.36 0.41 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.182 -0.463 . . . . 65.12 110.898 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 28.8 mm 50.1 78.18 0.42 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.612 0.72 . . . . 70.31 111.149 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 88.75 0.53 Allowed 'Trans proline' 0 C--N 1.342 0.208 0 C-N-CA 122.689 2.259 . . . . 72.24 112.356 179.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 36.8 p -78.6 -2.8 40.7 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.205 -0.452 . . . . 55.23 110.839 -179.823 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' -3' ' ' ARG . . . . . 0.445 ' HB2' ' CZ2' ' A' ' 36' ' ' TRP . 22.3 mmm-85 -49.92 160.53 0.63 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.616 0.722 . . . . 75.54 110.853 -179.933 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 -19.27 36.61 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.673 2.249 . . . . 54.43 112.337 179.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.54 84.29 0.18 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.596 0.712 . . . . 72.01 111.135 179.93 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.66 160.06 51.14 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.717 2.278 . . . . 73.51 112.365 -179.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.75 160.47 27.8 Favored Pre-proline 0 C--N 1.328 -0.34 0 CA-C-O 121.543 0.687 . . . . 54.13 110.884 179.893 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 167.28 24.91 Favored 'Trans proline' 0 C--O 1.231 0.156 0 C-N-CA 122.658 2.238 . . . . 72.42 112.338 179.867 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.81 -177.62 1.98 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.705 2.27 . . . . 62.31 112.313 179.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 27.0 t -171.68 133.62 0.78 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.221 -0.445 . . . . 60.05 110.842 -179.853 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 11.7 m -125.36 135.09 52.07 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.162 -0.472 . . . . 74.14 110.863 -179.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.294 0 CA-C-N 116.125 -0.489 . . . . 63.55 111.056 179.946 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.078 0 CA-C-O 120.781 0.324 . . . . 65.44 110.898 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . 0.61 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -51.99 160.82 1.07 Allowed Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.599 0.714 . . . . 64.51 111.108 179.91 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.61 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.7 Cg_endo -69.76 128.8 16.55 Favored 'Trans proline' 0 C--N 1.342 0.2 0 C-N-CA 122.677 2.251 . . . . 73.13 112.33 -179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.642 HD12 ' HB ' ' A' ' 28' ' ' ILE . 0.1 OUTLIER -112.25 125.01 53.7 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.153 -0.476 . . . . 72.43 110.899 179.993 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.462 ' CZ ' HD22 ' A' ' 60' ' ' LEU . 73.9 m-85 -140.89 139.8 34.44 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.215 -0.448 . . . . 75.22 110.889 179.934 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.698 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -128.22 159.61 34.66 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.113 -0.494 . . . . 64.34 111.094 179.946 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.426 HG23 ' O ' ' A' ' 24' ' ' GLU . 6.1 p -127.75 120.9 55.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.259 -0.428 . . . . 73.32 111.166 179.965 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.702 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.1 OUTLIER -62.98 128.48 36.07 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 71.2 111.143 -179.934 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.501 HD11 ' HB2' ' A' ' 56' ' ' ARG . 33.9 mt -101.57 -15.54 17.05 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.225 -0.443 . . . . 64.52 110.927 179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 18.0 m-85 -137.51 157.68 46.02 Favored 'General case' 0 C--N 1.328 -0.361 0 CA-C-N 116.204 -0.453 . . . . 75.54 110.948 179.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 6.3 tt0 -80.08 105.09 11.1 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.099 -0.5 . . . . 72.4 110.925 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 65.0 t80 -93.55 101.08 13.25 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 61.34 110.887 -179.907 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.34 121.54 25.24 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.156 -0.474 . . . . 75.5 110.915 179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.59 146.84 52.7 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 71.32 111.095 179.841 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -116.34 -26.63 7.08 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.238 -0.437 . . . . 75.22 110.853 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.2 mmt180 -124.36 178.53 5.33 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.194 -0.457 . . . . 74.41 110.862 -179.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -68.8 -26.71 65.33 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.192 -0.458 . . . . 71.01 110.849 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -77.36 -31.56 54.43 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.207 -0.451 . . . . 73.44 110.898 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 5.4 mm-40 -74.36 148.49 41.23 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.199 -0.455 . . . . 72.42 110.907 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.489 HD22 ' O ' ' A' ' 46' ' ' GLY . 5.7 tp -122.31 134.79 54.65 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.191 -0.459 . . . . 65.14 110.906 -179.947 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 7.2 p-10 -80.41 132.44 35.75 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.224 -0.444 . . . . 75.34 110.852 179.832 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.702 ' CG1' HG21 ' A' ' 6' ' ' THR . 9.7 p -146.38 147.05 18.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.176 -0.466 . . . . 71.53 111.115 179.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.3 m -107.83 160.27 27.42 Favored Pre-proline 0 C--N 1.33 -0.254 0 CA-C-O 121.667 0.746 . . . . 73.2 110.849 -179.837 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 125.91 12.68 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.7 2.266 . . . . 74.34 112.315 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.05 1.5 31.7 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.777 -0.725 . . . . 50.11 112.523 179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.426 ' O ' HG23 ' A' ' 5' ' ' VAL . 6.5 mm-40 -92.23 163.85 13.76 Favored 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.854 0.359 . . . . 64.42 110.927 -179.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 3.3 m120 -113.19 122.02 46.25 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.155 -0.475 . . . . 64.32 110.879 -179.905 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.797 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 2.3 mm? -117.1 151.69 36.27 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.159 -0.473 . . . . 75.0 110.925 179.957 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -99.78 112.58 24.81 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.469 . . . . 74.24 110.886 -179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.698 HD11 ' HB2' ' A' ' 4' ' ' ALA . 68.9 mt -77.88 143.35 12.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.337 0 CA-C-N 116.107 -0.497 . . . . 71.44 111.124 179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -118.94 -41.74 2.75 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.159 -0.473 . . . . 53.5 110.883 179.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.438 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -158.95 174.17 15.38 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.231 -0.441 . . . . 72.13 111.111 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.553 ' ND1' HD13 ' A' ' 81' ' ' ILE . 1.7 p80 -127.71 178.84 5.86 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.211 -0.449 . . . . 64.42 110.869 179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 61.3 t80 -138.34 100.25 4.06 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.191 -0.459 . . . . 75.32 110.895 -179.825 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 45.9 t0 54.98 25.49 6.94 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.131 -0.486 . . . . 71.1 110.856 179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.624 ' HD2' HD12 ' A' ' 81' ' ' ILE . 24.7 m-85 63.86 16.03 9.53 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.244 -0.435 . . . . 72.23 110.927 -179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.567 ' O ' HG23 ' A' ' 52' ' ' VAL . 28.9 mm-40 -103.46 -50.04 3.55 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.164 -0.471 . . . . 75.35 110.866 -179.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 81.6 m95 -112.42 164.64 13.03 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.12 -0.491 . . . . 73.44 110.923 -179.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.696 ' CD1' HG22 ' A' ' 52' ' ' VAL . 3.3 m-85 -138.23 155.94 48.17 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.223 -0.444 . . . . 73.54 110.884 179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 11.5 mm -113.94 94.29 3.04 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.331 0 CA-C-N 116.133 -0.485 . . . . 70.01 111.079 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.797 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -108.28 146.69 32.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.158 -0.474 . . . . 54.13 111.078 179.811 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.3 mttm -115.79 153.91 48.09 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.571 0.701 . . . . 72.42 110.886 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 118.67 5.82 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.664 2.242 . . . . 61.31 112.311 179.925 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 30.6 mt -89.21 -22.49 6.52 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.349 0 CA-C-N 116.189 -0.46 . . . . 54.23 111.149 179.882 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' A ASN . . . . . . . . . . . . . 28.7 t-20 -73.32 -66.36 0.7 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.179 -0.464 . . . . 73.45 110.833 179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' B ARG . . . . . . . . . . . . . 9.5 ptp85 -74.34 -172.98 1.57 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.15 -0.477 . . . . 63.43 110.905 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 15.9 mt -55.21 -74.61 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.21 -0.45 . . . . 65.1 110.934 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -167.97 164.33 37.88 Favored Glycine 0 N--CA 1.452 -0.288 0 C-N-CA 120.73 -0.748 . . . . 65.52 112.454 179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.489 ' O ' HD22 ' A' ' 18' ' ' LEU . . . 167.61 76.07 0.03 OUTLIER Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.751 -0.738 . . . . 75.25 112.467 -179.892 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.76 113.05 3.25 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.69 2.26 . . . . 73.42 112.329 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -117.86 -131.27 4.44 Favored Glycine 0 N--CA 1.451 -0.358 0 C-N-CA 120.752 -0.737 . . . . 71.24 112.488 179.987 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.4 HD23 ' HD2' ' B' ' -7' ' ' PHE . 0.0 OUTLIER -146.04 128.35 15.82 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.845 0.355 . . . . 71.11 110.91 -179.939 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 13.7 p -142.98 131.06 11.23 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.616 0.722 . . . . 73.24 111.146 179.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.662 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.4 Cg_endo -69.82 163.0 39.96 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.698 2.266 . . . . 75.1 112.283 179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.78 HG12 ' HB ' ' A' ' 71' ' ' THR . 9.6 t -69.88 -21.64 24.21 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.252 0 CA-C-N 116.221 -0.445 . . . . 74.24 111.155 179.914 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.2 m -80.48 -0.23 36.48 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.145 -0.48 . . . . 74.45 110.83 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 21.1 m-85 -124.36 12.88 8.82 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.132 -0.486 . . . . 74.2 110.945 -179.886 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.662 HG22 ' O ' ' A' ' 51' ' ' PRO . 10.3 m -152.84 139.27 12.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.099 -0.5 . . . . 73.22 111.164 179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.557 ' HG2' HG23 ' A' ' 58' ' ' ILE . 19.6 ttm180 -112.08 119.74 39.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.155 -0.475 . . . . 73.05 110.861 -179.954 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 16.5 mm -66.54 109.29 1.19 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.203 -0.453 . . . . 75.15 111.162 179.924 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.557 HG23 ' HG2' ' A' ' 56' ' ' ARG . 1.2 pt -131.6 128.19 60.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.176 -0.466 . . . . 45.44 111.157 179.855 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -63.72 126.28 27.07 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.148 -0.478 . . . . 74.22 110.89 179.869 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.462 HD22 ' CZ ' ' A' ' 3' ' ' PHE . 17.1 tp -58.26 -29.77 66.05 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.205 -0.452 . . . . 73.4 110.941 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 9.0 mmt -88.64 -1.45 58.07 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.198 -0.456 . . . . 74.42 110.849 179.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -170.88 82.6 0.53 Allowed Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.602 0.715 . . . . 75.33 110.909 179.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.739 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 54.0 Cg_endo -69.72 -7.12 20.23 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.678 2.252 . . . . 74.21 112.398 -179.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -100.69 -2.64 32.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.163 -0.471 . . . . 71.13 111.14 179.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 10.3 ttpt -81.58 -52.55 7.09 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.212 -0.449 . . . . 72.44 110.888 179.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.554 ' O ' HG12 ' A' ' 69' ' ' VAL . 32.8 m-85 -104.24 23.51 12.98 Favored 'General case' 0 C--N 1.328 -0.365 0 CA-C-N 116.271 -0.422 . . . . 74.14 110.934 -179.98 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.739 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -79.88 -18.24 51.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.144 -0.48 . . . . 72.45 111.117 179.854 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 1.8 p -106.12 22.85 15.0 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.225 -0.443 . . . . 63.11 110.875 -179.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 1.05 HG21 HD11 ' A' ' 80' ' ' ILE . 8.0 p -90.86 149.2 4.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.269 0 CA-C-N 116.15 -0.477 . . . . 74.01 111.165 179.921 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 23.5 m-20 -98.61 83.85 3.06 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.18 -0.464 . . . . 62.35 110.87 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.78 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.1 OUTLIER -51.25 -44.57 61.78 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 61.33 111.113 -179.883 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 71.5 t80 -54.15 -40.63 67.61 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.214 -0.448 . . . . 73.13 110.943 -179.902 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 61.4 t0 -63.71 107.34 1.16 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.121 -0.491 . . . . 73.02 110.843 179.909 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.7 -28.56 22.37 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.151 -0.477 . . . . 61.23 110.831 -179.896 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -66.89 -56.26 11.07 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.238 -0.437 . . . . 53.45 110.874 -179.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -59.25 -56.1 26.46 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.164 -0.471 . . . . 65.43 110.908 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 3.5 p -53.14 -32.12 18.53 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.234 -0.439 . . . . 75.34 111.135 179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 12.2 mtm -67.47 -54.55 19.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.21 -0.45 . . . . 72.44 110.887 179.889 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.6 mttp -55.63 -39.28 70.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.22 -0.445 . . . . 72.11 110.906 179.956 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 1.05 HD11 HG21 ' A' ' 69' ' ' VAL . 83.3 mt -64.34 -54.9 25.27 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.177 -0.465 . . . . 71.04 111.156 179.871 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.782 HG23 ' HB ' ' A' ' 86' ' ' ILE . 97.1 mt -59.91 -35.36 60.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.156 -0.475 . . . . 74.42 111.166 179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.6 t0 -69.09 -49.38 57.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.175 -0.466 . . . . 60.43 110.894 179.85 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 10.0 mm-40 -62.23 -43.57 98.53 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.177 -0.465 . . . . 73.33 110.879 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -75.5 -18.23 59.88 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.124 -0.489 . . . . 71.44 110.857 -179.88 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 60.1 mmtt 63.18 49.53 3.31 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.157 -0.474 . . . . 72.42 110.904 179.975 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.782 ' HB ' HG23 ' A' ' 81' ' ' ILE . 21.1 mt -77.33 129.65 77.02 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.618 0.723 . . . . 64.13 111.156 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.438 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 54.2 Cg_endo -69.74 163.29 38.8 Favored 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.704 2.269 . . . . 74.4 112.356 179.891 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -91.85 166.17 12.87 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.248 -0.433 . . . . 72.1 111.108 -179.935 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 91.4 t -50.66 -54.58 9.12 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 65.34 111.128 179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 -51.34 -49.11 62.04 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.173 -0.467 . . . . 61.42 110.917 -180.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 73.9 mm-40 -56.98 -46.47 82.2 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.15 -0.477 . . . . 52.45 110.919 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 25.6 t90 -59.14 -37.79 78.12 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.228 -0.442 . . . . 74.21 110.91 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -67.09 -43.53 82.34 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.231 -0.44 . . . . 75.41 110.892 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 2.5 t70 -65.5 -36.07 82.76 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.263 -0.426 . . . . 73.53 110.858 179.87 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 31.6 mt-30 -72.96 -38.0 66.9 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.199 -0.455 . . . . 70.31 110.913 -179.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 5.9 p -74.85 -44.33 49.67 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.204 -0.453 . . . . 64.32 111.168 -179.929 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -66.6 -34.46 77.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.181 -0.463 . . . . 74.43 110.839 -179.969 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 10.6 ptt85 -80.22 -32.28 38.53 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.191 -0.459 . . . . 71.13 110.886 -179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 15.0 t80 -80.8 -23.61 39.14 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.199 -0.455 . . . . 71.12 110.924 -179.829 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.7 mmmm -88.41 -17.08 31.25 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.133 -0.485 . . . . 72.03 110.906 179.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 15.2 pt-20 -51.09 167.73 0.07 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.21 -0.45 . . . . 72.34 110.918 179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 32.2 p -90.69 78.19 6.23 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.158 -0.474 . . . . 72.31 110.819 -179.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 75.0 m -100.92 -174.83 2.71 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.117 -0.492 . . . . 64.33 110.846 -179.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.405 HG22 ' N ' ' A' ' 105' ' ' GLN . 7.6 mm -98.88 160.73 3.19 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.116 -0.493 . . . . 62.54 111.126 179.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.405 ' N ' HG22 ' A' ' 104' ' ' ILE . 2.8 mt-30 -69.48 -168.79 0.18 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.124 -0.489 . . . . 74.43 110.915 179.931 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.2 mp -131.2 134.42 61.26 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.155 -0.475 . . . . 62.1 111.12 179.953 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -81.31 64.3 4.19 Favored Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.759 -0.734 . . . . 72.01 112.486 179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 23.6 p-10 -106.27 141.75 37.1 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.85 0.357 . . . . 65.21 110.891 -179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -107.78 178.94 21.77 Favored Glycine 0 N--CA 1.451 -0.316 0 C-N-CA 120.74 -0.743 . . . . 44.22 112.469 179.963 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 41.6 m80 -109.25 162.1 14.62 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-O 120.894 0.378 . . . . 63.22 110.807 -179.932 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -77.09 -162.98 17.06 Favored Glycine 0 N--CA 1.451 -0.3 0 C-N-CA 120.719 -0.753 . . . . 61.54 112.465 -179.943 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -153.18 154.6 35.06 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-O 120.801 0.334 . . . . 72.53 110.902 -179.93 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 5.4 m -136.53 126.96 26.72 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 63.54 110.864 -179.758 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -165.53 140.65 4.99 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.117 -0.492 . . . . 70.33 110.877 -179.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -135.5 99.9 0.33 Allowed Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.773 -0.727 . . . . 72.33 112.507 -179.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 49.6 mt -80.81 -61.12 2.06 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.814 0.34 . . . . 63.41 110.924 -179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 6.6 tm-20 . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.191 -0.459 . . . . 73.54 110.885 179.939 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.314 0 N-CA-C 112.525 -0.23 . . . . 54.21 112.525 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -119.16 -33.03 4.25 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-O 120.884 0.373 . . . . 71.13 110.935 -179.971 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' -7' ' ' PHE . . . . . 0.4 ' HD2' HD23 ' A' ' 49' ' ' LEU . 31.8 m-85 -72.14 -75.13 0.14 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.197 -0.456 . . . . 71.41 110.845 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 31.2 mm 51.18 81.42 0.26 Allowed Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.649 0.738 . . . . 62.22 111.146 179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.81 81.7 0.81 Allowed 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.676 2.251 . . . . 61.54 112.323 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 40.6 t -89.06 3.0 53.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.24 -0.436 . . . . 74.01 110.84 -179.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -50.97 162.83 0.55 Allowed Pre-proline 0 C--N 1.329 -0.322 0 CA-C-O 121.606 0.717 . . . . 64.45 110.836 -179.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 -23.05 31.36 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.684 2.256 . . . . 51.03 112.344 179.97 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.01 90.49 0.09 OUTLIER Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.583 0.706 . . . . 71.02 111.07 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 158.41 57.0 Favored 'Trans proline' 0 C--O 1.232 0.179 0 C-N-CA 122.71 2.273 . . . . 63.32 112.311 -179.99 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -91.97 150.38 40.47 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.566 0.698 . . . . 72.55 110.926 179.887 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 166.21 28.36 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.622 2.214 . . . . 73.12 112.358 179.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.82 111.99 2.97 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.656 2.237 . . . . 75.5 112.342 179.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -55.22 -40.26 70.61 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.221 -0.445 . . . . 75.22 110.874 -179.843 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 4.1 p -52.27 -35.02 48.97 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.124 -0.489 . . . . 64.22 110.826 -179.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.179 -0.464 . . . . 65.31 111.06 179.92 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 3.8 ptt? . . . . . 0 C--O 1.23 0.072 0 CA-C-O 120.766 0.317 . . . . 73.22 110.884 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . 0.584 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -93.97 160.15 32.95 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.565 0.698 . . . . 51.54 111.071 179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.584 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 54.1 Cg_endo -69.72 120.09 6.93 Favored 'Trans proline' 0 C--O 1.232 0.203 0 C-N-CA 122.687 2.258 . . . . 73.54 112.364 179.987 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.447 HD11 ' HB ' ' A' ' 28' ' ' ILE . 0.7 OUTLIER -118.93 156.17 30.02 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.24 -0.437 . . . . 74.11 110.932 179.973 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.599 ' HB2' HD23 ' A' ' 60' ' ' LEU . 68.0 m-85 -139.49 163.42 32.59 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.199 -0.455 . . . . 75.1 110.887 179.911 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.504 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -134.44 167.15 21.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.149 -0.478 . . . . 53.21 111.098 179.95 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.3 p -128.51 128.86 68.57 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.198 -0.456 . . . . 74.32 111.157 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.693 HG21 HG11 ' A' ' 20' ' ' VAL . 0.7 OUTLIER -72.16 138.42 47.63 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.181 -0.463 . . . . 63.43 111.132 -179.961 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.632 HD11 ' HB2' ' A' ' 56' ' ' ARG . 18.0 mt -114.47 -15.39 12.06 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.229 -0.441 . . . . 62.35 110.956 179.913 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 46.8 m-85 -137.42 158.35 44.6 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.139 -0.482 . . . . 73.1 110.927 179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.7 tt0 -83.04 104.83 13.54 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.1 -0.5 . . . . 64.35 110.874 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 60.1 t80 -88.96 103.81 16.38 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.192 -0.458 . . . . 73.13 110.892 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 10.1 mttm -79.4 112.05 16.26 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.14 -0.482 . . . . 62.34 110.918 179.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.616 ' HB1' ' HB2' ' A' ' 17' ' ' GLU . . . -71.85 163.11 28.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.237 -0.438 . . . . 63.05 111.122 179.818 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 20.2 pt-20 -119.01 -31.46 4.74 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.198 -0.456 . . . . 73.44 110.909 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 35.1 mmm-85 -139.38 -174.76 3.96 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.147 -0.479 . . . . 55.15 110.814 -179.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -64.54 -39.93 94.66 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.158 -0.474 . . . . 45.42 110.823 179.999 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -54.41 -28.0 40.72 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.194 -0.457 . . . . 73.32 110.87 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.616 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 40.0 mm-40 -88.98 -178.16 5.64 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.176 -0.465 . . . . 74.42 110.909 -179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.585 HD13 ' O ' ' A' ' 46' ' ' GLY . 56.6 tp -150.41 123.18 8.64 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.122 -0.49 . . . . 60.24 110.912 -179.937 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 29.9 t70 -80.53 124.52 29.02 Favored 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.214 -0.448 . . . . 72.35 110.913 179.816 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.693 HG11 HG21 ' A' ' 6' ' ' THR . 7.4 p -139.53 155.06 25.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.231 -0.441 . . . . 62.3 111.123 179.994 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.0 m -111.11 159.34 33.08 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.65 0.738 . . . . 75.22 110.829 -179.815 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 123.01 9.67 Favored 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.642 2.228 . . . . 72.41 112.32 -179.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 108.41 -3.32 32.81 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.775 -0.726 . . . . 61.05 112.488 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 32.4 mm-40 -89.98 145.7 24.91 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.891 0.377 . . . . 75.31 110.874 -179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 4.3 m120 -86.67 142.06 28.49 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.18 -0.464 . . . . 75.31 110.842 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.54 HD11 HG21 ' A' ' 20' ' ' VAL . 5.3 mp -144.46 151.91 39.86 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.174 -0.466 . . . . 71.41 110.922 179.978 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 11.5 t -107.08 125.56 51.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.223 -0.444 . . . . 64.13 110.876 -179.942 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.504 HD11 ' HB2' ' A' ' 4' ' ' ALA . 53.5 mt -86.06 143.97 10.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.128 -0.487 . . . . 71.53 111.146 179.971 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 23.5 m -112.55 -37.72 4.84 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.18 -0.464 . . . . 74.05 110.922 179.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -164.27 176.16 9.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.203 -0.453 . . . . 74.51 111.129 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.428 ' CE1' HG21 ' A' ' 81' ' ' ILE . 1.6 p80 -126.61 178.26 6.01 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.221 -0.445 . . . . 74.41 110.876 179.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.73 ' OH ' HG23 ' B' ' -6' ' ' ILE . 40.5 t80 -141.03 99.65 3.64 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.211 -0.45 . . . . 72.25 110.903 -179.801 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 54.92 24.01 5.5 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.129 -0.487 . . . . 62.01 110.858 179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.593 ' HD2' HD12 ' A' ' 81' ' ' ILE . 35.7 m-85 63.6 15.3 8.79 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.201 -0.454 . . . . 75.03 110.92 -179.855 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.431 ' O ' HG23 ' A' ' 52' ' ' VAL . 22.0 mm-40 -103.32 -49.17 3.79 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.103 -0.498 . . . . 74.43 110.896 -179.983 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 73.6 m95 -114.52 146.16 41.05 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 70.41 110.918 -179.985 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.726 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -119.18 149.11 42.28 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.244 -0.435 . . . . 75.34 110.897 -179.965 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.2 mm -108.53 96.27 4.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.128 -0.487 . . . . 74.25 111.103 179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.464 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -105.71 161.62 14.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.142 -0.481 . . . . 73.2 111.133 179.797 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -136.59 158.32 73.45 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.534 0.683 . . . . 71.14 110.879 179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.79 131.87 22.1 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.689 2.26 . . . . 64.31 112.372 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 27.0 mm -81.59 -45.55 20.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.22 -0.446 . . . . 75.13 111.104 179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' A ASN . . . . . . . . . . . . . 2.7 m120 -109.64 -44.26 3.89 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.198 -0.456 . . . . 71.1 110.928 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' B ARG . . . . . . . . . . . . . 4.2 mmt180 -51.8 169.87 0.06 Allowed 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.15 -0.477 . . . . 72.44 110.844 -179.98 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 10.3 mp -54.75 120.35 6.65 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 74.14 110.923 -179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -47.2 120.22 5.29 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.753 -0.736 . . . . 63.54 112.517 179.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.585 ' O ' HD13 ' A' ' 18' ' ' LEU . . . 178.16 81.84 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.36 0 C-N-CA 120.767 -0.73 . . . . 53.23 112.474 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 141.03 44.09 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.701 2.267 . . . . 63.4 112.337 -179.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -126.19 -105.34 1.44 Allowed Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.719 -0.753 . . . . 62.21 112.447 179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -162.63 125.69 2.86 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.85 0.357 . . . . 63.25 110.896 -179.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.413 HG23 ' HD2' ' A' ' 51' ' ' PRO . 10.0 p -136.51 132.99 18.95 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.583 0.706 . . . . 74.42 111.107 179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.51 ' O ' HG22 ' A' ' 55' ' ' VAL . 54.0 Cg_endo -69.74 144.87 55.53 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.686 2.257 . . . . 61.41 112.347 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.726 HG22 ' CD2' ' A' ' 37' ' ' PHE . 18.4 t -58.24 -22.15 19.08 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.188 -0.46 . . . . 72.24 111.16 179.868 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 18.1 m -77.61 -2.55 36.41 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.154 -0.476 . . . . 71.52 110.814 -179.8 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.443 ' O ' HG13 ' A' ' 55' ' ' VAL . 10.8 m-85 -125.82 22.93 7.38 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.132 -0.485 . . . . 73.35 110.91 -179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.51 HG22 ' O ' ' A' ' 51' ' ' PRO . 1.7 m -156.27 154.75 6.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.121 -0.491 . . . . 60.13 111.121 179.919 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.632 ' HB2' HD11 ' A' ' 7' ' ' LEU . 37.6 ttm-85 -121.41 128.44 52.19 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.187 -0.46 . . . . 74.54 110.873 -179.98 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.631 HD11 ' CE2' ' A' ' 37' ' ' PHE . 42.5 mm -76.72 110.02 11.74 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.183 -0.462 . . . . 52.32 111.136 179.984 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.404 HG23 ' HG2' ' A' ' 56' ' ' ARG . 7.0 pt -126.13 -177.78 1.84 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.147 -0.479 . . . . 54.44 111.082 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -126.09 124.48 40.7 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.162 -0.472 . . . . 45.4 110.895 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.599 HD23 ' HB2' ' A' ' 3' ' ' PHE . 0.4 OUTLIER -55.02 -26.39 36.91 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.187 -0.46 . . . . 74.22 110.913 -179.94 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 2.6 mpp? -90.17 -25.57 20.59 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.196 -0.456 . . . . 64.5 110.917 179.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -147.83 75.0 11.11 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.601 0.715 . . . . 63.41 110.872 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.724 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.8 Cg_endo -69.79 -8.39 23.49 Favored 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.676 2.251 . . . . 73.43 112.331 -179.979 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -100.14 -12.92 19.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 52.01 111.132 179.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 9.5 ttmm -80.02 -52.1 8.24 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.191 -0.459 . . . . 52.34 110.908 179.95 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.435 ' O ' HG12 ' A' ' 69' ' ' VAL . 78.9 m-85 -95.45 23.11 6.24 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.446 . . . . 75.43 110.931 -179.926 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.724 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -90.06 9.91 26.25 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.104 -0.498 . . . . 74.23 111.101 179.909 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 64.4 p -116.62 -24.13 7.91 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.221 -0.445 . . . . 74.45 110.796 -179.769 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.527 HG21 ' CD1' ' A' ' 80' ' ' ILE . 13.9 p -56.65 135.28 20.45 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.17 -0.468 . . . . 71.33 111.12 179.999 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -90.33 100.67 13.46 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.208 -0.451 . . . . 74.14 110.848 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.698 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -57.78 -30.47 65.68 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.198 -0.455 . . . . 71.15 111.115 -179.851 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 5.7 t80 -62.72 -44.64 95.7 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.228 -0.442 . . . . 73.32 110.916 -179.923 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 58.6 t0 -63.72 106.56 1.0 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.121 -0.491 . . . . 72.52 110.869 179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.44 -27.94 27.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.221 -0.445 . . . . 72.43 110.851 -179.894 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 14.9 mt-10 -66.52 -54.46 23.52 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.213 -0.449 . . . . 74.02 110.884 -179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.455 ' O ' HD12 ' A' ' 80' ' ' ILE . 28.2 mt-30 -59.75 -57.62 12.13 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.146 -0.479 . . . . 73.45 110.912 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 4.3 p -51.89 -32.76 15.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.162 -0.472 . . . . 72.51 111.12 179.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 16.5 mtm -67.87 -50.82 54.29 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.179 -0.464 . . . . 54.24 110.902 179.871 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 29.4 mttt -56.28 -43.86 79.23 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.254 -0.43 . . . . 52.41 110.854 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.591 HG21 HG21 ' A' ' 57' ' ' ILE . 1.6 mp -63.97 -54.82 26.83 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.321 0 CA-C-N 116.227 -0.442 . . . . 74.11 111.131 179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.651 HG23 ' HB ' ' A' ' 86' ' ' ILE . 87.2 mt -57.68 -37.02 56.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.33 0 CA-C-N 116.222 -0.445 . . . . 72.53 111.129 179.861 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -71.07 -51.71 23.63 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.21 -0.45 . . . . 64.24 110.834 179.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 28.9 mm-40 -59.47 -50.26 74.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.235 -0.439 . . . . 74.5 110.898 -179.907 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 8.5 m-85 -67.88 -13.42 62.13 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.157 -0.474 . . . . 71.1 110.906 -179.949 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 63.1 mmtt 61.11 48.36 6.44 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.097 -0.501 . . . . 73.43 110.906 179.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.651 ' HB ' HG23 ' A' ' 81' ' ' ILE . 24.6 mt -81.66 122.43 80.48 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.651 0.739 . . . . 71.11 111.118 179.886 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.8 159.49 53.2 Favored 'Trans proline' 0 C--N 1.342 0.205 0 C-N-CA 122.703 2.269 . . . . 72.53 112.32 179.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.407 HG22 ' O ' ' A' ' 31' ' ' HIS . 0.1 OUTLIER -81.38 174.81 11.12 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.216 -0.447 . . . . 73.42 111.1 -179.931 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.817 HG12 ' HE2' ' A' ' 93' ' ' LYS . 24.1 t -53.81 -58.53 3.23 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.268 0 CA-C-N 116.189 -0.459 . . . . 62.22 111.136 179.898 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 58.0 mt-10 -50.75 -47.68 59.4 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.198 -0.455 . . . . 72.33 110.874 -179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 74.0 mm-40 -56.12 -39.24 71.9 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.191 -0.458 . . . . 73.55 110.912 -179.957 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 25.8 t90 -62.03 -48.43 80.31 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.2 -0.455 . . . . 73.44 110.89 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.817 ' HE2' HG12 ' A' ' 89' ' ' VAL . 17.7 mtmt -58.09 -50.79 72.26 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.217 -0.447 . . . . 73.23 110.897 179.931 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.7 t70 -58.35 -51.68 68.79 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.258 -0.428 . . . . 53.14 110.865 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 13.1 mt-30 -50.63 -52.56 38.43 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.232 -0.44 . . . . 75.4 110.897 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -57.86 -39.05 76.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.186 -0.461 . . . . 74.33 111.118 -179.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 12.1 mmm180 -59.33 -45.51 91.16 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.248 -0.433 . . . . 71.2 110.883 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 10.7 mmm180 -65.13 -45.22 85.96 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.19 -0.459 . . . . 52.24 110.84 -179.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 24.3 t80 -67.53 -25.13 65.68 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.191 -0.459 . . . . 60.25 110.925 -179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 1.8 mtpm? -88.07 -25.81 22.86 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.118 -0.492 . . . . 71.4 110.907 179.938 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 6.7 pt-20 -93.4 -176.16 4.03 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.208 -0.451 . . . . 73.02 110.884 179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 7.7 t -52.08 158.35 1.12 Allowed 'General case' 0 C--N 1.33 -0.263 0 CA-C-N 116.152 -0.476 . . . . 65.33 110.86 -179.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -86.68 176.7 7.63 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.149 -0.478 . . . . 61.31 110.812 -179.775 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 4.9 mm -105.82 162.36 5.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.293 0 CA-C-N 116.125 -0.489 . . . . 73.52 111.154 179.911 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 7.6 pt20 -52.14 171.39 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 74.01 110.941 179.905 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.7 mp -117.92 98.31 6.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.245 -0.434 . . . . 64.42 111.114 179.971 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -134.23 107.78 0.68 Allowed Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.693 -0.765 . . . . 74.42 112.486 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 11.5 p30 -76.88 133.05 39.41 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.856 0.36 . . . . 72.41 110.906 -179.904 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -117.59 100.78 0.89 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.739 -0.743 . . . . 43.4 112.481 179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 3.3 t-80 -145.58 156.41 43.67 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.839 0.352 . . . . 72.43 110.865 -179.933 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 159.56 114.56 0.38 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.788 -0.72 . . . . 64.45 112.497 -179.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.6 pm0 -175.64 149.2 0.95 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.786 0.327 . . . . 75.34 110.915 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 65.9 m -141.85 172.64 12.4 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 63.25 110.896 -179.867 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -151.61 166.52 30.96 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.108 -0.496 . . . . 73.41 110.931 -179.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -140.56 137.74 8.5 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.723 -0.751 . . . . 60.44 112.468 -179.998 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 73.7 mt -110.01 -179.73 3.88 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.755 0.312 . . . . 74.22 110.923 -179.936 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 35.1 mm-40 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.21 -0.45 . . . . 53.52 110.897 179.964 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 N-CA-C 112.458 -0.257 . . . . 62.45 112.458 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 4.6 tttp -137.25 -51.76 0.66 Allowed 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.815 0.341 . . . . 71.43 110.866 -179.945 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 55.7 m-85 -94.11 -78.21 0.44 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.228 -0.442 . . . . 72.05 110.866 -179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' -6' ' ' ILE . . . . . 0.73 HG23 ' OH ' ' A' ' 32' ' ' TYR . 3.5 mp 47.95 84.73 0.19 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.618 0.723 . . . . 74.41 111.103 179.992 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 85.53 0.61 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.688 2.259 . . . . 72.44 112.361 179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 1.3 t -74.28 -8.47 56.33 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.216 -0.447 . . . . 61.31 110.888 -179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -57.08 160.39 6.37 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.609 0.719 . . . . 71.21 110.872 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 154.65 67.72 Favored 'Trans proline' 0 C--O 1.232 0.181 0 C-N-CA 122.688 2.258 . . . . 74.33 112.333 -179.988 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . -107.92 87.42 3.73 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.565 0.698 . . . . 70.13 111.108 179.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 149.0 66.57 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.721 2.281 . . . . 74.32 112.374 179.991 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.0 159.91 64.5 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.58 0.705 . . . . 74.44 110.86 179.947 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 167.11 25.46 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.626 2.217 . . . . 54.41 112.351 179.913 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -36.45 10.69 Favored 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.69 2.26 . . . . 64.24 112.335 179.993 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 19.4 t -106.99 121.29 44.16 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.265 -0.425 . . . . 74.14 110.839 -179.852 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 50.6 m -122.15 97.8 5.64 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.136 -0.484 . . . . 71.14 110.841 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.285 0 CA-C-N 116.107 -0.497 . . . . 74.24 111.065 179.927 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 20.7 ptm . . . . . 0 C--O 1.231 0.124 0 CA-C-O 120.762 0.315 . . . . 45.31 110.922 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . 0.568 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -130.66 160.3 66.93 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.582 0.706 . . . . 55.44 111.089 179.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.568 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.1 Cg_endo -69.82 86.73 0.58 Allowed 'Trans proline' 0 C--O 1.232 0.223 0 C-N-CA 122.708 2.272 . . . . 54.22 112.302 -179.995 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -95.31 149.86 20.88 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.209 -0.451 . . . . 62.43 110.96 179.93 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.474 ' CE1' HD12 ' A' ' 60' ' ' LEU . 14.0 m-85 -128.23 163.14 25.37 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.209 -0.45 . . . . 71.25 110.913 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.428 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -134.6 170.05 16.38 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.131 -0.486 . . . . 73.52 111.122 179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.559 HG23 ' O ' ' A' ' 24' ' ' GLU . 8.4 p -133.14 131.27 58.46 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.249 -0.432 . . . . 74.32 111.092 179.993 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.723 HG21 ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -75.05 134.53 41.37 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.183 -0.462 . . . . 71.04 111.171 179.98 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.66 HD11 ' HB2' ' A' ' 56' ' ' ARG . 15.6 mt -109.22 -13.05 14.72 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 62.13 110.919 179.963 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 47.5 m-85 -137.31 156.23 48.49 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.164 -0.471 . . . . 70.14 110.896 -179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -83.55 104.98 14.12 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.11 -0.495 . . . . 54.2 110.886 -179.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 66.8 t80 -108.72 102.43 11.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.178 -0.465 . . . . 74.21 110.848 -179.897 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 24.7 mmtp -78.96 124.34 28.16 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.114 -0.494 . . . . 73.45 110.928 179.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.588 ' HB1' ' HB2' ' A' ' 17' ' ' GLU . . . -65.41 145.4 56.21 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.238 -0.437 . . . . 72.24 111.105 179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -96.65 -31.62 12.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.259 -0.428 . . . . 55.4 110.899 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 19.8 mmm180 -140.21 179.17 6.79 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.136 -0.484 . . . . 75.24 110.907 -179.893 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 1.1 p30 -59.87 -29.78 68.55 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.216 -0.447 . . . . 75.04 110.906 179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -65.15 -24.56 67.43 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.184 -0.462 . . . . 64.5 110.868 179.994 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.588 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 44.4 mm-40 -104.79 147.92 27.18 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.459 . . . . 71.43 110.896 -179.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.546 HD13 ' O ' ' A' ' 46' ' ' GLY . 5.2 tp -118.12 119.18 33.97 Favored 'General case' 0 C--N 1.328 -0.367 0 CA-C-N 116.165 -0.47 . . . . 74.41 110.965 179.987 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -57.31 141.34 47.22 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.158 -0.474 . . . . 63.54 110.865 179.858 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.723 ' HB ' HG21 ' A' ' 6' ' ' THR . 0.8 OUTLIER -145.4 158.69 13.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.176 -0.465 . . . . 73.24 111.124 -179.987 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.5 m -129.09 160.32 64.33 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.656 0.741 . . . . 73.11 110.877 -179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 119.46 6.41 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.687 2.258 . . . . 72.24 112.374 179.939 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.49 -0.46 30.86 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.741 -0.742 . . . . 51.41 112.468 179.978 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.559 ' O ' HG23 ' A' ' 5' ' ' VAL . 4.7 mp0 -88.24 166.0 14.64 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.82 0.343 . . . . 70.21 110.888 -179.881 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.468 ' CB ' HD12 ' A' ' 42' ' ' ILE . 4.4 m120 -117.38 127.03 53.64 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.168 -0.469 . . . . 64.43 110.917 -179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.589 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 2.2 mp -127.41 158.99 35.83 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 74.34 110.917 179.984 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 4.0 t -111.13 114.87 28.45 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.187 -0.46 . . . . 74.2 110.878 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.428 HD11 ' HB2' ' A' ' 4' ' ' ALA . 57.2 mt -79.69 144.61 10.59 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.332 0 CA-C-N 116.17 -0.468 . . . . 75.13 111.143 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 29.3 m -118.36 -41.65 2.83 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.181 -0.463 . . . . 74.34 110.899 179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.411 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -155.67 174.63 15.02 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.18 -0.464 . . . . 74.42 111.093 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.471 ' ND1' HD13 ' A' ' 81' ' ' ILE . 1.3 p80 -126.89 177.73 6.41 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.229 -0.441 . . . . 70.21 110.868 179.998 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 35.2 t80 -139.91 99.56 3.72 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.204 -0.453 . . . . 75.32 110.941 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER 55.11 25.16 6.8 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.154 -0.475 . . . . 64.02 110.843 179.909 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.59 ' HD2' HD12 ' A' ' 81' ' ' ILE . 34.2 m-85 63.48 16.3 9.48 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.225 -0.443 . . . . 74.11 110.935 -179.806 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.465 ' O ' HG23 ' A' ' 52' ' ' VAL . 12.2 mm-40 -103.62 -50.32 3.46 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.132 -0.485 . . . . 73.51 110.935 179.978 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.427 ' CZ2' ' HB2' ' B' ' -3' ' ' ARG . 78.5 m95 -113.06 153.78 27.6 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.09 -0.505 . . . . 75.54 110.923 -179.976 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.634 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.4 OUTLIER -126.38 142.64 51.46 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.25 -0.432 . . . . 71.32 110.933 -179.998 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 21.7 mm -99.16 95.64 4.41 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.154 -0.475 . . . . 74.24 111.109 -179.988 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.589 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -108.1 152.86 23.96 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.187 -0.461 . . . . 73.14 111.13 179.754 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 29.2 mtpt -125.1 159.49 59.03 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.589 0.709 . . . . 74.42 110.905 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.7 139.74 41.17 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.67 2.247 . . . . 74.55 112.381 179.892 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.468 HD12 ' CB ' ' A' ' 25' ' ' ASN . 44.2 mt -101.33 -23.65 4.32 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.218 -0.447 . . . . 75.31 111.177 179.884 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' A ASN . . . . . . . . . . . . . 20.6 t-20 -92.83 -32.35 14.67 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.186 -0.461 . . . . 73.3 110.879 179.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' B ARG . . . . . . . . . . . . . 15.5 mmp_? -73.2 -168.98 0.56 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.198 -0.455 . . . . 75.32 110.893 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -103.16 12.08 36.21 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 74.22 110.964 179.999 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 119.85 124.24 3.19 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.742 -0.742 . . . . 73.01 112.487 179.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.546 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -171.01 76.67 0.1 OUTLIER Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.752 -0.737 . . . . 51.34 112.458 -179.926 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 116.97 4.81 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.654 2.236 . . . . 64.54 112.357 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -116.91 -111.8 2.65 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.751 -0.738 . . . . 71.35 112.518 179.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -172.12 124.61 0.52 Allowed 'General case' 0 C--N 1.328 -0.351 0 CA-C-O 120.843 0.354 . . . . 65.24 110.949 -179.912 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.42 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.1 p -139.46 132.98 15.65 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.58 0.705 . . . . 64.23 111.146 179.862 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.579 ' O ' HG22 ' A' ' 55' ' ' VAL . 53.1 Cg_endo -69.75 160.58 49.19 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.66 2.24 . . . . 73.23 112.325 179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.764 HG12 ' HB ' ' A' ' 71' ' ' THR . 8.4 t -72.11 -20.97 20.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.191 -0.459 . . . . 64.02 111.114 179.911 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 9.0 m -79.15 -0.17 30.69 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.191 -0.459 . . . . 72.44 110.832 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 36.1 m-85 -127.49 17.36 7.0 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.15 -0.477 . . . . 71.41 110.947 -179.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.579 HG22 ' O ' ' A' ' 51' ' ' PRO . 16.8 m -151.87 161.15 3.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.086 -0.507 . . . . 53.43 111.115 179.892 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.66 ' HB2' HD11 ' A' ' 7' ' ' LEU . 39.0 ttm-85 -128.99 131.75 47.47 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.166 -0.47 . . . . 61.32 110.845 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.404 HG21 HG21 ' A' ' 80' ' ' ILE . 31.1 mm -80.59 108.85 14.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.199 -0.455 . . . . 75.43 111.124 179.957 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.445 HG23 ' HG2' ' A' ' 56' ' ' ARG . 4.6 pt -126.81 140.19 49.7 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.202 -0.454 . . . . 64.54 111.078 179.868 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 8.7 m-20 -76.36 128.57 35.1 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.136 -0.483 . . . . 71.05 110.872 179.832 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.474 HD12 ' CE1' ' A' ' 3' ' ' PHE . 0.6 OUTLIER -60.42 -34.97 74.72 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.181 -0.463 . . . . 73.34 110.872 -179.943 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.1 mmt -83.78 -1.6 54.58 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.232 -0.44 . . . . 73.04 110.894 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 3.6 t0 -178.91 82.93 0.21 Allowed Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.665 0.745 . . . . 62.02 110.884 179.962 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.724 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.3 Cg_endo -69.81 -7.93 22.31 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.704 2.27 . . . . 71.31 112.284 -179.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -92.46 -8.49 44.53 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.237 -0.438 . . . . 73.12 111.146 179.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -81.97 -47.09 13.12 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.206 -0.452 . . . . 62.21 110.883 179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.641 ' O ' HG12 ' A' ' 69' ' ' VAL . 14.2 m-85 -103.72 23.47 12.69 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.247 -0.433 . . . . 73.31 110.916 -179.956 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.724 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -84.23 -16.87 41.73 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.14 -0.482 . . . . 54.01 111.09 179.887 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 39.8 p -94.18 -23.76 17.78 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.236 -0.438 . . . . 71.34 110.829 -179.734 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.988 HG21 HD11 ' A' ' 80' ' ' ILE . 9.8 p -51.33 155.95 0.47 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.083 -0.508 . . . . 73.23 111.168 179.941 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 1.8 t0 -113.31 106.77 15.0 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.173 -0.467 . . . . 75.42 110.857 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.764 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.1 OUTLIER -70.5 -20.81 62.81 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.22 -0.445 . . . . 75.03 111.14 -179.906 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.6 t80 -62.77 -54.91 31.86 Favored 'General case' 0 C--N 1.327 -0.376 0 CA-C-N 116.231 -0.441 . . . . 74.11 110.91 -179.953 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 41.8 t0 -63.89 116.73 6.09 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 73.54 110.893 179.884 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -57.48 -22.14 41.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.181 -0.463 . . . . 75.15 110.896 -179.893 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 26.7 mt-10 -66.84 -56.01 12.27 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.175 -0.466 . . . . 74.34 110.928 -179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -58.71 -57.12 14.43 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.194 -0.457 . . . . 62.24 110.924 -179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.513 ' HA ' HD12 ' A' ' 80' ' ' ILE . 3.2 p -52.72 -31.91 16.81 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.196 -0.456 . . . . 73.2 111.13 179.948 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.8 mtm -67.57 -55.12 14.66 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.192 -0.458 . . . . 61.23 110.865 179.929 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 50.8 mttt -55.36 -38.64 69.08 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.201 -0.454 . . . . 75.24 110.944 179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.988 HD11 HG21 ' A' ' 69' ' ' VAL . 15.4 mt -65.3 -53.08 44.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.328 0 CA-C-N 116.226 -0.443 . . . . 73.53 111.105 179.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.721 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.1 mt -61.95 -35.9 70.9 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.23 -0.441 . . . . 73.02 111.145 179.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -71.02 -44.77 65.16 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.177 -0.465 . . . . 72.41 110.905 179.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 60.9 mm-40 -67.89 -47.84 67.71 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.173 -0.467 . . . . 71.2 110.891 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -69.21 -11.5 60.85 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.166 -0.47 . . . . 74.5 110.86 -179.923 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 45.9 mmtt 58.32 53.89 6.08 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.187 -0.461 . . . . 72.45 110.887 179.989 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.721 ' HB ' HG23 ' A' ' 81' ' ' ILE . 23.7 mt -88.14 124.33 66.88 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.619 0.723 . . . . 75.24 111.134 179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.411 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 53.3 Cg_endo -69.76 164.15 35.63 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.642 2.228 . . . . 54.44 112.33 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -88.97 167.33 13.28 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.179 -0.464 . . . . 65.41 111.128 -179.974 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.473 ' O ' ' HG2' ' A' ' 93' ' ' LYS . 97.7 t -50.61 -58.41 1.79 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.204 -0.453 . . . . 74.13 111.122 179.906 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -46.05 -53.16 10.67 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.154 -0.475 . . . . 72.13 110.906 -179.965 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 74.9 mm-40 -56.38 -34.16 66.41 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.146 -0.479 . . . . 63.01 110.913 -179.948 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . 0.453 ' O ' HG23 ' A' ' 96' ' ' THR . 26.8 t90 -71.25 -36.2 71.68 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-N 116.199 -0.455 . . . . 74.53 110.878 -179.954 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.473 ' HG2' ' O ' ' A' ' 89' ' ' VAL . 1.6 mmmt -68.62 -37.56 79.85 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.209 -0.451 . . . . 71.23 110.917 179.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 37.0 t0 -71.38 -50.83 28.2 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.227 -0.442 . . . . 74.23 110.888 179.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . 0.412 ' HG2' ' HA ' ' A' ' 92' ' ' TRP . 5.1 pt20 -58.8 -38.83 79.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.194 -0.457 . . . . 73.13 110.867 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . 0.453 HG23 ' O ' ' A' ' 92' ' ' TRP . 26.2 p -70.56 -47.47 60.14 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.251 -0.431 . . . . 62.34 111.093 -179.902 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -56.19 -45.04 79.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.445 . . . . 72.43 110.867 -179.938 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 6.0 ptm180 -74.3 -34.87 63.65 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.243 -0.435 . . . . 63.33 110.857 -179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 10.4 t80 -64.22 -35.26 80.23 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.177 -0.465 . . . . 71.44 110.939 -179.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 38.2 mmtt -77.69 -25.5 49.49 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.109 -0.496 . . . . 73.02 110.922 179.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 12.0 mm-40 -67.94 176.69 2.47 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.191 -0.459 . . . . 71.43 110.872 179.992 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 30.0 t -58.05 113.87 2.1 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.183 -0.462 . . . . 70.1 110.856 -179.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 17.1 m -160.26 -173.28 3.95 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.148 -0.478 . . . . 74.42 110.888 -179.838 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 12.5 mm -81.07 154.21 4.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.182 -0.463 . . . . 64.42 111.149 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -171.51 -179.03 2.46 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.169 -0.469 . . . . 70.15 110.926 179.922 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.1 mp -127.23 104.32 12.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.229 -0.441 . . . . 63.54 111.122 179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 102.03 179.11 27.73 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.751 -0.737 . . . . 63.24 112.487 179.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 35.4 m120 -78.06 120.97 23.64 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-O 120.898 0.38 . . . . 54.52 110.913 -179.921 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -89.61 171.85 38.45 Favored Glycine 0 N--CA 1.451 -0.344 0 C-N-CA 120.764 -0.731 . . . . 34.3 112.502 179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 68.6 m80 -119.19 158.82 25.22 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.91 0.386 . . . . 72.04 110.829 -179.969 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -167.48 103.9 0.21 Allowed Glycine 0 N--CA 1.451 -0.335 0 C-N-CA 120.747 -0.74 . . . . 65.52 112.492 -179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 16.5 mp0 -122.32 170.29 10.08 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.842 0.353 . . . . 70.41 110.899 -179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 3.2 p -169.44 151.44 4.47 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.164 -0.471 . . . . 75.02 110.86 -179.769 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 39.0 mt-30 -134.75 153.78 51.86 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.135 -0.484 . . . . 74.33 110.939 -180.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . -140.82 113.79 0.89 Allowed Glycine 0 N--CA 1.45 -0.4 0 C-N-CA 120.789 -0.72 . . . . 71.03 112.537 -179.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -109.62 -32.05 7.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.771 0.32 . . . . 51.41 110.908 -179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 60.8 mt-10 . . . . . 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 74.24 110.909 179.953 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.344 0 N-CA-C 112.495 -0.242 . . . . 70.4 112.495 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 12.1 tptt -71.02 -74.1 0.16 Allowed 'General case' 0 C--N 1.328 -0.347 0 CA-C-O 120.834 0.35 . . . . 63.24 110.852 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 56.5 m-85 -76.11 -71.83 0.36 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.242 -0.435 . . . . 73.45 110.91 179.99 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.8 mm 51.41 74.37 0.81 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.651 0.739 . . . . 42.03 111.119 179.979 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.8 101.26 0.9 Allowed 'Trans proline' 0 C--O 1.231 0.15 0 C-N-CA 122.703 2.268 . . . . 75.04 112.326 179.883 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 24.2 t -89.33 1.47 55.73 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.185 -0.461 . . . . 71.1 110.841 -179.837 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' -3' ' ' ARG . . . . . 0.427 ' HB2' ' CZ2' ' A' ' 36' ' ' TRP . 19.7 mmt-85 -50.75 160.38 0.79 Allowed Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.589 0.709 . . . . 74.34 110.915 -179.946 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 -22.88 31.62 Favored 'Trans proline' 0 N--CA 1.465 -0.173 0 C-N-CA 122.725 2.283 . . . . 45.42 112.354 -179.995 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.6 85.03 0.17 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.585 0.707 . . . . 74.33 111.122 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 159.45 53.41 Favored 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.742 2.295 . . . . 73.14 112.303 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 11.4 mtpt -94.7 160.08 32.12 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.565 0.698 . . . . 74.13 110.9 179.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 166.66 26.76 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.668 2.245 . . . . 63.33 112.369 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 -23.64 30.6 Favored 'Trans proline' 0 C--O 1.231 0.145 0 C-N-CA 122.7 2.267 . . . . 71.41 112.332 179.936 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 2.4 p -52.21 -37.78 55.97 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.235 -0.438 . . . . 75.21 110.88 -179.834 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 2.1 m -132.62 138.34 47.34 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.144 -0.48 . . . . 64.43 110.894 -179.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.33 -0.274 0 CA-C-N 116.11 -0.496 . . . . 62.13 111.135 179.91 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 11.3 tpt . . . . . 0 C--O 1.231 0.116 0 CA-C-O 120.823 0.344 . . . . 65.23 110.866 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . 0.474 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -143.09 156.94 61.46 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.569 0.7 . . . . 71.13 111.077 179.914 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.474 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 54.2 Cg_endo -69.73 83.74 0.68 Allowed 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.659 2.24 . . . . 72.53 112.383 179.977 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.462 ' H ' HD23 ' A' ' 2' ' ' LEU . 1.3 pt? -67.08 146.06 54.69 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.187 -0.46 . . . . 74.32 110.932 -179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 12.0 m-85 -112.06 145.15 40.23 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.258 -0.428 . . . . 65.32 110.893 179.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.608 ' HB1' HG13 ' A' ' 55' ' ' VAL . . . -126.66 153.57 45.21 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.126 -0.488 . . . . 73.31 111.118 179.957 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 24' ' ' GLU . 6.6 p -121.66 122.5 67.16 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.24 -0.436 . . . . 60.11 111.129 179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -59.18 140.17 56.19 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.197 -0.456 . . . . 64.31 111.126 -179.964 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.586 HD21 ' HB2' ' A' ' 56' ' ' ARG . 3.5 mt -106.04 -16.42 14.62 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.204 -0.453 . . . . 70.44 110.907 179.983 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 48.1 m-85 -139.25 164.31 30.16 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.194 -0.457 . . . . 61.24 110.911 -179.98 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 20.3 tt0 -87.19 104.8 16.71 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.115 -0.493 . . . . 72.01 110.895 179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 45.3 t80 -106.74 109.37 21.26 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.173 -0.467 . . . . 73.23 110.86 -179.916 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.2 mttm -83.84 142.24 30.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.105 -0.498 . . . . 75.44 110.947 179.909 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -69.62 136.1 50.78 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.266 -0.425 . . . . 60.21 111.093 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -105.53 -26.61 11.82 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.211 -0.449 . . . . 72.41 110.884 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 21.9 mmt180 -127.1 -178.59 4.48 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.123 -0.49 . . . . 63.43 110.886 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 85.7 m-20 -67.43 -25.97 66.18 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.184 -0.462 . . . . 64.13 110.879 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -81.74 -45.6 15.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 73.01 110.823 -179.967 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.6 mm-40 -55.88 158.27 3.85 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.248 -0.433 . . . . 70.52 110.939 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.612 HD13 ' O ' ' A' ' 46' ' ' GLY . 3.4 tp -133.73 145.81 50.2 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.21 -0.45 . . . . 65.24 110.918 -179.972 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -82.65 130.74 35.17 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 74.13 110.881 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.989 HG11 HD21 ' A' ' 26' ' ' LEU . 0.2 OUTLIER -139.96 158.93 26.65 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.237 -0.438 . . . . 75.34 111.149 179.984 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -125.18 159.09 61.15 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.692 0.758 . . . . 55.3 110.873 -179.858 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 117.78 5.29 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.698 2.265 . . . . 72.53 112.312 -179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.25 7.12 35.61 Favored Glycine 0 N--CA 1.451 -0.35 0 C-N-CA 120.756 -0.735 . . . . 53.11 112.495 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.468 ' O ' HG23 ' A' ' 5' ' ' VAL . 24.4 mm-40 -92.2 153.69 19.14 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-O 120.898 0.38 . . . . 44.12 110.872 -179.876 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.644 ' HB3' HD12 ' A' ' 42' ' ' ILE . 7.0 m120 -94.8 123.11 38.07 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.158 -0.474 . . . . 75.44 110.855 -179.92 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.989 HD21 HG11 ' A' ' 20' ' ' VAL . 7.9 mp -124.1 149.32 46.32 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 116.208 -0.451 . . . . 71.32 110.907 179.944 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -101.79 123.89 46.5 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.196 -0.457 . . . . 63.41 110.889 -179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 31.7 mm -74.74 144.84 11.78 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.132 -0.485 . . . . 72.41 111.087 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 55.8 m -124.6 -35.2 2.76 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.134 -0.485 . . . . 64.53 110.888 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -176.03 171.9 2.49 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.192 -0.458 . . . . 30.25 111.088 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.474 ' CE1' HG21 ' A' ' 81' ' ' ILE . 1.7 p80 -124.95 173.35 8.71 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.205 -0.452 . . . . 55.44 110.86 -179.968 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 40.8 t80 -135.39 99.55 4.26 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.241 -0.436 . . . . 63.22 110.906 -179.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 42.8 t0 53.88 26.46 6.2 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.116 -0.493 . . . . 54.44 110.878 179.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.53 ' HD2' HD12 ' A' ' 81' ' ' ILE . 43.7 m-85 62.77 27.77 16.21 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 64.1 110.938 -179.81 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -116.69 -48.24 2.68 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 65.32 110.9 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 70.1 m95 -114.09 145.86 41.04 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.153 -0.476 . . . . 73.24 110.942 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.575 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -121.08 139.46 53.29 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.258 -0.428 . . . . 72.51 110.9 -179.931 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 24.6 mm -95.02 95.21 4.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-N 116.191 -0.459 . . . . 72.04 111.124 179.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.811 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -107.55 145.06 33.68 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 73.42 111.102 179.807 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -123.53 156.59 64.09 Favored Pre-proline 0 C--N 1.328 -0.353 0 CA-C-O 121.567 0.698 . . . . 75.23 110.89 179.973 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 125.71 12.45 Favored 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.672 2.248 . . . . 63.21 112.367 179.901 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.644 HD12 ' HB3' ' A' ' 25' ' ' ASN . 58.4 mt -83.85 -35.54 11.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.219 -0.446 . . . . 71.45 111.131 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' A ASN . . . . . . . . . . . . . 31.8 m-20 -73.57 -44.51 57.16 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.157 -0.474 . . . . 64.21 110.917 179.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' B ARG . . . . . . . . . . . . . 18.8 mmt180 -60.79 -169.67 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.134 -0.484 . . . . 74.51 110.921 -179.983 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -98.54 -15.9 19.35 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.24 -0.436 . . . . 71.33 110.905 -179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 150.98 111.97 0.54 Allowed Glycine 0 N--CA 1.451 -0.356 0 C-N-CA 120.783 -0.722 . . . . 65.22 112.524 179.908 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.612 ' O ' HD13 ' A' ' 18' ' ' LEU . . . -155.43 66.77 0.31 Allowed Glycine 0 N--CA 1.452 -0.277 0 C-N-CA 120.723 -0.751 . . . . 71.41 112.47 -179.907 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.68 114.01 3.55 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.678 2.252 . . . . 64.25 112.351 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -116.72 -122.19 3.33 Favored Glycine 0 N--CA 1.451 -0.326 0 C-N-CA 120.787 -0.721 . . . . 65.01 112.5 179.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -160.18 125.3 3.93 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.846 0.355 . . . . 71.24 110.882 -179.88 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.426 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.2 p -139.98 133.29 15.23 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.609 0.719 . . . . 51.14 111.134 179.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.426 ' HD2' HG23 ' A' ' 50' ' ' VAL . 54.4 Cg_endo -69.75 150.32 68.14 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.683 2.255 . . . . 75.23 112.378 179.909 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.726 HG12 ' HB ' ' A' ' 71' ' ' THR . 21.6 t -58.0 -22.06 18.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 72.42 111.142 179.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.9 m -77.97 -2.08 35.19 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.186 -0.461 . . . . 50.22 110.822 -179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -126.1 10.19 7.49 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.181 -0.463 . . . . 72.14 110.912 -179.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.608 HG13 ' HB1' ' A' ' 4' ' ' ALA . 2.4 t -147.21 139.73 19.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.285 0 CA-C-N 116.114 -0.494 . . . . 71.32 111.107 179.899 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.586 ' HB2' HD21 ' A' ' 7' ' ' LEU . 31.9 ttm180 -104.97 131.21 52.77 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.197 -0.456 . . . . 71.14 110.904 -179.993 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.496 HG21 HG21 ' A' ' 80' ' ' ILE . 30.0 mm -87.16 108.94 18.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.251 -0.431 . . . . 73.21 111.126 179.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.554 HG23 ' HG2' ' A' ' 56' ' ' ARG . 3.1 pt -123.01 160.47 25.71 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.284 0 CA-C-N 116.142 -0.481 . . . . 74.12 111.101 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 60.8 t0 -97.38 125.38 41.97 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.151 -0.477 . . . . 74.13 110.844 179.836 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mt -51.65 -37.55 50.87 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.154 -0.476 . . . . 52.34 110.928 -179.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -80.79 -31.27 35.79 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.141 -0.481 . . . . 71.11 110.912 179.818 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . 0.42 ' HB2' ' HB2' ' A' ' 65' ' ' LYS . 0.1 OUTLIER -137.69 78.32 37.22 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.606 0.717 . . . . 72.21 110.898 179.969 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.766 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.7 Cg_endo -69.8 -8.12 22.8 Favored 'Trans proline' 0 C--N 1.342 0.194 0 C-N-CA 122.641 2.227 . . . . 61.15 112.354 -179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -96.84 -33.68 11.56 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.198 -0.456 . . . . 35.4 111.123 179.839 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . 0.42 ' HB2' ' HB2' ' A' ' 62' ' ' ASP . 0.0 OUTLIER -65.14 -51.8 59.04 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.19 -0.459 . . . . 50.12 110.87 179.989 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.525 ' HA ' HG23 ' A' ' 69' ' ' VAL . 20.3 m-85 -90.78 18.95 5.89 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.242 -0.436 . . . . 75.04 110.933 -179.947 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.766 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -84.14 -23.06 30.81 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.122 -0.49 . . . . 73.22 111.11 179.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 47.3 t -94.6 -5.68 45.25 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.253 -0.431 . . . . 71.1 110.844 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.525 HG23 ' HA ' ' A' ' 66' ' ' TYR . 53.6 t -51.26 121.78 1.87 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.117 -0.492 . . . . 75.21 111.147 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 52.5 m-20 -77.53 75.72 4.08 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.189 -0.46 . . . . 62.3 110.864 179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.726 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -47.43 -34.16 6.91 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.22 -0.446 . . . . 62.22 111.136 -179.853 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 73.1 t80 -58.71 -44.47 90.39 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.218 -0.446 . . . . 72.43 110.898 -179.932 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 38.7 t0 -69.09 113.98 6.95 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.104 -0.498 . . . . 73.13 110.866 179.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -56.22 -23.77 37.85 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.185 -0.461 . . . . 74.35 110.884 -179.888 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 6.8 mt-10 -65.78 -54.98 19.83 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.193 -0.458 . . . . 74.03 110.872 -179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . 0.715 ' O ' HD12 ' A' ' 80' ' ' ILE . 4.5 mm-40 -58.67 -58.23 9.51 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.185 -0.461 . . . . 73.32 110.875 -179.942 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -51.61 -31.68 12.91 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.344 0 CA-C-N 116.274 -0.421 . . . . 73.45 111.171 179.945 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 9.2 mtm -68.71 -51.11 45.2 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.104 -0.498 . . . . 61.12 110.846 179.961 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 28.3 mttm -56.95 -43.36 81.49 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.218 -0.447 . . . . 74.42 110.86 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.715 HD12 ' O ' ' A' ' 76' ' ' GLN . 1.8 mp -64.43 -53.35 43.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.214 -0.448 . . . . 73.21 111.15 179.857 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.53 HD12 ' HD2' ' A' ' 34' ' ' TYR . 88.5 mt -59.64 -36.65 66.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.195 -0.457 . . . . 72.44 111.113 179.819 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -71.17 -52.25 20.23 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.225 -0.443 . . . . 63.43 110.891 179.868 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 20.9 mm-40 -60.77 -50.84 71.86 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.19 -0.459 . . . . 65.11 110.894 -179.923 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 9.9 m-85 -67.82 -15.07 63.45 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.149 -0.478 . . . . 75.21 110.9 -179.926 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 13.7 mmtp 57.88 51.82 8.65 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.121 -0.49 . . . . 71.5 110.923 179.969 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.449 HD12 HG12 ' A' ' 81' ' ' ILE . 27.8 mt -77.94 131.5 69.91 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.658 0.742 . . . . 71.35 111.123 179.854 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 152.0 69.29 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.661 2.24 . . . . 73.43 112.352 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -82.73 170.24 15.3 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.222 -0.445 . . . . 75.0 111.188 179.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.443 HG23 ' O ' ' A' ' 31' ' ' HIS . 95.2 t -52.01 -55.2 10.59 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.275 0 CA-C-N 116.253 -0.43 . . . . 70.31 111.166 179.896 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 24.6 mt-10 -51.95 -46.42 64.75 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.142 -0.481 . . . . 70.34 110.868 179.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 58.7 mm-40 -59.68 -42.7 93.5 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.169 -0.469 . . . . 73.33 110.936 -179.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 25.3 t90 -64.94 -38.26 90.38 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.228 -0.442 . . . . 74.44 110.925 -179.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -64.86 -49.54 70.12 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.217 -0.447 . . . . 74.43 110.923 179.91 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 7.0 m-20 -61.65 -45.44 94.04 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.209 -0.45 . . . . 73.23 110.843 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -58.78 -51.67 68.98 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 74.12 110.881 -179.898 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 5.5 p -59.5 -46.01 90.05 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.156 -0.474 . . . . 73.34 111.182 -179.931 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 20.2 mmt180 -57.16 -45.41 83.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.252 -0.431 . . . . 75.35 110.857 179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 33.0 mtp180 -69.45 -32.29 71.12 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.206 -0.452 . . . . 75.23 110.888 -179.881 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 10.5 t80 -68.51 -37.56 80.17 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 75.5 110.971 -179.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 61.0 mmtt -81.93 -23.77 35.99 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.065 -0.516 . . . . 74.22 110.883 179.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 3.3 tt0 -93.55 136.31 33.96 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.256 -0.429 . . . . 74.14 110.933 179.952 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 4.7 t 63.51 46.57 4.21 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.152 -0.476 . . . . 72.4 110.87 -179.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 16.8 m -62.43 -170.63 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.092 -0.504 . . . . 53.31 110.857 -179.816 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 43.0 mm -51.59 145.84 2.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.322 0 CA-C-N 116.124 -0.489 . . . . 71.1 111.133 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 29.2 pt20 -171.52 -173.35 1.2 Allowed 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.142 -0.481 . . . . 71.31 110.867 179.93 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.7 mt -111.47 146.26 16.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.175 -0.466 . . . . 74.33 111.088 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . -52.41 137.48 34.13 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.721 -0.752 . . . . 64.22 112.49 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -91.62 149.78 21.48 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.842 0.353 . . . . 62.12 110.895 -179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -52.39 171.9 0.39 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.724 -0.75 . . . . 51.42 112.514 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 39.3 t-80 -52.84 -29.32 27.25 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-O 120.82 0.343 . . . . 73.22 110.856 -179.991 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -83.55 54.18 4.93 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.727 -0.749 . . . . 42.12 112.527 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 5.6 tm0? -176.73 122.78 0.15 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.792 0.329 . . . . 73.52 110.916 -179.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 51.3 m -96.03 143.05 27.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.195 -0.457 . . . . 71.31 110.866 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 19.4 mp0 -88.9 -74.52 0.46 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.115 -0.493 . . . . 74.52 110.932 179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 86.36 53.78 2.86 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.726 -0.749 . . . . 52.33 112.474 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -135.04 175.24 9.76 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.796 0.331 . . . . 64.32 110.919 -179.936 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 . . . . . 0 C--N 1.33 -0.267 0 CA-C-N 116.167 -0.469 . . . . 71.32 110.872 179.949 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.339 0 N-CA-C 112.477 -0.249 . . . . 74.03 112.477 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.46 45.48 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.873 0.368 . . . . 75.43 110.888 -179.975 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 10.4 m-85 -84.04 -76.38 0.3 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.239 -0.437 . . . . 74.55 110.902 179.95 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 22.3 mm 50.51 80.3 0.3 Allowed Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.661 0.743 . . . . 73.31 111.138 179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 113.49 3.39 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.668 2.245 . . . . 62.33 112.351 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -123.92 56.6 1.23 Allowed 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.234 -0.439 . . . . 42.32 110.82 -179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' -3' ' ' ARG . . . . . 0.4 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 0.1 OUTLIER -109.94 163.59 16.77 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.591 0.71 . . . . 72.2 110.873 -179.928 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' -2' ' ' PRO . . . . . 0.4 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.4 Cg_endo -69.84 -6.46 18.69 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.655 2.237 . . . . 54.33 112.359 -179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 51.47 88.13 0.12 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.554 0.692 . . . . 74.52 111.105 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.76 126.6 13.5 Favored 'Trans proline' 0 C--O 1.232 0.184 0 C-N-CA 122.678 2.252 . . . . 42.25 112.371 179.971 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 19.2 mtmm -66.34 160.1 67.94 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.532 0.682 . . . . 75.32 110.931 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.74 167.32 24.76 Favored 'Trans proline' 0 N--CA 1.465 -0.172 0 C-N-CA 122.719 2.279 . . . . 75.53 112.372 179.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 129.47 17.64 Favored 'Trans proline' 0 N--CA 1.466 -0.141 0 C-N-CA 122.719 2.279 . . . . 70.34 112.322 179.963 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 1.7 t -164.04 146.34 9.18 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.206 -0.452 . . . . 72.35 110.835 -179.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 3.7 t -68.93 -27.68 65.97 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.1 -0.5 . . . . 74.01 110.835 -179.834 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.3 0 CA-C-N 116.159 -0.473 . . . . 74.43 111.064 179.897 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 2.7 ttt . . . . . 0 C--O 1.231 0.086 0 CA-C-O 120.813 0.339 . . . . 73.42 110.838 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . 0.587 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -92.84 160.35 34.18 Favored Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.568 0.699 . . . . 71.42 111.148 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.587 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.8 Cg_endo -69.76 115.46 4.1 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 122.708 2.272 . . . . 73.43 112.297 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.9 pp -122.21 134.43 54.71 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.215 -0.448 . . . . 72.1 110.942 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 13.5 m-85 -117.45 163.61 16.13 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.212 -0.449 . . . . 73.31 110.881 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.429 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -134.93 164.13 28.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.157 -0.474 . . . . 64.55 111.118 179.925 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.623 HG23 ' O ' ' A' ' 24' ' ' GLU . 7.6 p -131.6 131.09 62.63 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.248 -0.433 . . . . 74.02 111.148 179.996 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.713 HG21 ' CG1' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -72.87 136.56 45.32 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.194 -0.457 . . . . 73.14 111.137 -179.971 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.669 HD11 ' HB2' ' A' ' 56' ' ' ARG . 17.4 mt -108.37 -16.07 14.32 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.194 -0.457 . . . . 73.44 110.917 179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 41.6 m-85 -135.35 161.85 34.26 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.209 -0.451 . . . . 53.31 110.909 -180.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 7.1 tp10 -84.35 105.02 14.87 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.085 -0.507 . . . . 73.31 110.895 179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 50.5 t80 -89.61 100.24 13.08 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.148 -0.478 . . . . 54.54 110.912 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 25.8 mmtp -80.23 106.85 12.56 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 74.13 110.868 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.526 ' HB1' ' HB2' ' A' ' 17' ' ' GLU . . . -58.23 152.83 16.38 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.195 -0.457 . . . . 73.51 111.098 179.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 10.6 pt-20 -113.73 -30.97 6.61 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.242 -0.435 . . . . 73.34 110.92 -179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.5 mmp_? -121.21 -179.85 4.18 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.136 -0.484 . . . . 63.13 110.906 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 4.4 t70 -64.12 -39.1 93.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.196 -0.456 . . . . 62.0 110.844 179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -63.11 -50.82 69.0 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.224 -0.443 . . . . 71.33 110.865 -179.978 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.526 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 55.5 mm-40 -55.07 135.65 48.84 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.229 -0.441 . . . . 72.35 110.894 -179.919 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 1.7 tp -108.37 136.93 47.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.191 -0.459 . . . . 64.12 110.907 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -85.18 128.68 34.76 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.196 -0.457 . . . . 64.23 110.859 179.834 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.713 ' CG1' HG21 ' A' ' 6' ' ' THR . 7.1 p -140.19 143.3 29.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.266 0 CA-C-N 116.184 -0.462 . . . . 64.44 111.127 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.6 m -101.81 160.36 26.7 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.688 0.756 . . . . 33.41 110.836 -179.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.75 121.79 8.48 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.711 2.274 . . . . 75.35 112.319 179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.12 5.69 30.36 Favored Glycine 0 N--CA 1.451 -0.302 0 C-N-CA 120.701 -0.761 . . . . 72.14 112.479 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . 0.623 ' O ' HG23 ' A' ' 5' ' ' VAL . 29.5 mt-10 -92.2 169.2 10.8 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-O 120.883 0.373 . . . . 72.41 110.884 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 9.2 m120 -113.51 123.33 49.76 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.174 -0.466 . . . . 74.14 110.836 -179.877 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.694 HD11 HG21 ' A' ' 20' ' ' VAL . 4.4 mp -123.18 150.12 43.75 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.109 -0.496 . . . . 71.23 110.929 179.956 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -105.94 112.92 26.17 Favored 'General case' 0 C--N 1.33 -0.283 0 CA-C-N 116.175 -0.466 . . . . 63.43 110.832 -179.916 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.429 HD11 ' HB2' ' A' ' 4' ' ' ALA . 59.6 mt -76.77 145.36 10.41 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.324 0 CA-C-N 116.151 -0.477 . . . . 74.2 111.17 179.893 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.7 m -119.51 -32.6 4.29 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.137 -0.483 . . . . 75.41 110.874 179.957 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.418 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -170.04 174.09 5.66 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.209 -0.45 . . . . 42.22 111.08 -179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.416 ' CG ' HD13 ' A' ' 81' ' ' ILE . 2.7 p80 -123.77 178.02 5.44 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.19 -0.459 . . . . 64.33 110.844 179.993 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 20.9 t80 -150.66 104.67 3.22 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 65.42 110.912 -179.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER 59.93 17.75 6.89 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.111 -0.495 . . . . 72.34 110.859 179.874 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.61 ' HD2' HD12 ' A' ' 81' ' ' ILE . 24.1 m-85 60.97 20.82 11.17 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.167 -0.47 . . . . 73.22 110.902 -179.871 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -117.68 -24.42 7.24 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.098 -0.501 . . . . 71.43 110.912 179.992 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.408 ' HB3' HD21 ' A' ' 49' ' ' LEU . 81.3 m95 -132.23 135.81 46.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.107 -0.497 . . . . 75.13 110.902 -179.97 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.615 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.6 OUTLIER -118.08 131.99 56.4 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.202 -0.453 . . . . 74.21 110.877 -179.937 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 10.4 mm -89.13 94.74 4.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.174 -0.466 . . . . 53.41 111.142 179.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.408 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -115.54 152.34 33.21 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.196 -0.457 . . . . 60.05 111.085 179.843 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 2.0 ptpp? -122.44 157.05 60.05 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.563 0.696 . . . . 72.32 110.908 179.986 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 136.7 33.76 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.683 2.255 . . . . 75.1 112.372 179.86 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 69.1 mt -106.27 -44.1 7.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.223 -0.444 . . . . 64.5 111.155 179.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' A ASN . . . . . . . . . . . . . 7.9 t-20 -57.11 -74.7 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.157 -0.474 . . . . 72.33 110.904 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' B ARG . . . . . 0.548 ' O ' HD22 ' A' ' 44' ' ' LEU . 7.6 ptp85 -79.86 -177.26 5.86 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.141 -0.481 . . . . 63.51 110.852 -179.989 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.548 HD22 ' O ' ' A' ' 43' B ARG . 4.0 mm? -123.46 113.63 19.02 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.16 -0.473 . . . . 64.42 110.891 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -146.51 -73.42 0.02 OUTLIER Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.765 -0.731 . . . . 75.22 112.476 179.924 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 166.68 165.48 24.13 Favored Glycine 0 N--CA 1.452 -0.295 0 C-N-CA 120.754 -0.736 . . . . 74.4 112.496 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 140.4 42.57 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.717 2.278 . . . . 73.44 112.321 -179.95 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -129.63 -138.29 4.39 Favored Glycine 0 N--CA 1.452 -0.299 0 C-N-CA 120.753 -0.737 . . . . 52.44 112.472 179.969 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.417 HD12 ' HB3' ' B' ' -7' ' ' PHE . 0.7 OUTLIER -148.46 126.88 12.31 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.86 0.362 . . . . 72.14 110.885 -179.901 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.419 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.5 p -136.8 133.45 18.85 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.597 0.713 . . . . 73.14 111.126 179.82 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.419 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.6 Cg_endo -69.77 158.4 57.06 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.665 2.244 . . . . 73.4 112.349 179.932 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.781 HG12 ' HB ' ' A' ' 71' ' ' THR . 6.9 t -70.09 -20.57 23.17 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.297 0 CA-C-N 116.232 -0.44 . . . . 70.31 111.138 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 24.9 m -81.24 3.82 22.55 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.176 -0.465 . . . . 62.22 110.853 -179.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . 0.499 ' O ' HG22 ' A' ' 6' ' ' THR . 17.0 m-85 -131.94 22.1 4.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.158 -0.474 . . . . 65.32 110.918 -179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.412 HG22 ' O ' ' A' ' 51' ' ' PRO . 18.8 m -152.14 160.34 3.45 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.274 0 CA-C-N 116.107 -0.497 . . . . 74.22 111.163 179.905 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.669 ' HB2' HD11 ' A' ' 7' ' ' LEU . 21.4 ttp180 -127.62 120.56 28.38 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.228 -0.442 . . . . 73.05 110.89 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 42.6 mm -71.9 123.03 25.46 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.179 -0.464 . . . . 62.34 111.083 179.973 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.433 HG23 ' HG2' ' A' ' 56' ' ' ARG . 16.0 pt -141.86 172.07 10.2 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.311 0 CA-C-N 116.184 -0.462 . . . . 71.42 111.143 179.816 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 48.8 t0 -119.42 129.74 54.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.176 -0.466 . . . . 74.42 110.883 179.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.406 HD23 ' HA ' ' A' ' 60' ' ' LEU . 16.6 mt -53.57 -27.73 27.97 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.177 -0.465 . . . . 72.03 110.908 -179.908 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 27.2 mmt -88.01 -31.69 19.2 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.197 -0.456 . . . . 74.23 110.864 179.836 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -139.44 73.7 35.73 Favored Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.596 0.712 . . . . 73.12 110.863 -179.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.531 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.8 Cg_endo -69.73 -8.58 23.97 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.731 2.288 . . . . 51.12 112.331 -179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -103.33 -12.8 17.0 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.225 -0.443 . . . . 72.32 111.091 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 14.8 ttmt -75.23 -51.77 12.52 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.211 -0.45 . . . . 71.12 110.906 179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.623 ' O ' HG12 ' A' ' 69' ' ' VAL . 61.6 m-85 -96.77 23.13 7.35 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.201 -0.454 . . . . 73.43 110.943 -179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.531 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -85.83 -18.64 32.32 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.126 -0.488 . . . . 74.32 111.135 179.839 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 35.6 t -94.21 -23.42 17.9 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.194 -0.457 . . . . 62.4 110.904 -179.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.994 HG21 HD11 ' A' ' 80' ' ' ILE . 7.4 p -51.29 154.83 0.52 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.119 -0.492 . . . . 74.22 111.118 179.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 5.3 t0 -107.89 110.24 21.95 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 61.32 110.853 179.893 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.781 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -71.65 -38.88 70.66 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.219 -0.446 . . . . 75.5 111.145 -179.913 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -55.11 -42.16 72.56 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.197 -0.456 . . . . 75.03 110.925 -179.946 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 52.9 t0 -63.9 105.66 0.88 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.126 -0.488 . . . . 74.14 110.924 179.898 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -52.01 -29.24 20.02 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 72.43 110.845 -179.903 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -66.98 -56.17 11.3 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.207 -0.451 . . . . 62.42 110.862 -179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.2 mt-30 -59.1 -55.07 39.76 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.184 -0.462 . . . . 71.04 110.905 -179.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.463 ' HA ' HD12 ' A' ' 80' ' ' ILE . 5.4 p -54.24 -32.7 24.06 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.213 -0.449 . . . . 64.25 111.138 179.971 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 10.3 mtm -67.3 -55.68 12.9 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.146 -0.479 . . . . 45.45 110.9 179.913 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 24.8 mttm -55.02 -38.25 67.68 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.235 -0.438 . . . . 65.12 110.883 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.994 HD11 HG21 ' A' ' 69' ' ' VAL . 34.4 mt -65.46 -54.88 23.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.202 -0.454 . . . . 72.13 111.132 179.909 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.73 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.8 mt -61.0 -36.1 69.97 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.139 -0.482 . . . . 64.04 111.149 179.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 15.1 t70 -71.03 -47.68 57.28 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.177 -0.465 . . . . 73.34 110.861 179.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -63.03 -52.36 63.14 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.162 -0.472 . . . . 64.13 110.88 -179.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 20.1 m-85 -67.87 -15.8 63.79 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.149 -0.478 . . . . 71.41 110.866 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 23.6 mmtm 60.95 62.07 1.51 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.134 -0.484 . . . . 74.42 110.944 -179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.73 ' HB ' HG23 ' A' ' 81' ' ' ILE . 54.7 mt -92.05 132.42 32.6 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.615 0.722 . . . . 52.14 111.144 179.889 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.418 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 53.6 Cg_endo -69.81 169.93 17.84 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.707 2.272 . . . . 73.42 112.314 179.92 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -106.07 177.73 4.77 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.178 -0.465 . . . . 64.43 111.115 -179.913 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 21.5 t -59.82 -52.79 56.94 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.204 -0.453 . . . . 71.02 111.118 179.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -54.15 -52.65 60.43 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.161 -0.472 . . . . 60.44 110.874 -179.955 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 35.1 mt-30 -60.64 -38.78 85.95 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.156 -0.475 . . . . 73.32 110.937 -179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 31.2 t90 -66.45 -37.91 86.2 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.21 -0.45 . . . . 71.53 110.879 -179.988 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 1.3 mmpt? -66.95 -49.38 65.64 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.273 -0.422 . . . . 73.14 110.899 179.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -61.74 -43.57 98.6 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.184 -0.462 . . . . 74.5 110.882 179.845 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 8.2 mm100 -61.0 -52.91 63.01 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.171 -0.468 . . . . 73.43 110.89 -179.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 10.9 p -59.99 -35.85 75.9 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.184 -0.462 . . . . 75.31 111.166 -179.937 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 2.1 mmt85 -65.53 -54.98 20.39 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.199 -0.455 . . . . 71.43 110.887 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 1.3 ptp180 -68.97 -19.48 64.16 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.183 -0.462 . . . . 73.12 110.882 -179.917 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -87.23 -26.89 23.28 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.185 -0.461 . . . . 71.4 110.931 -179.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 2.4 mtpm? -87.63 -25.35 23.59 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.076 -0.511 . . . . 73.42 110.893 179.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 11.3 pt-20 -51.74 168.57 0.08 Allowed 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.228 -0.442 . . . . 72.24 110.914 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 47.1 t -54.42 116.95 2.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.47 . . . . 63.22 110.86 -179.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 97.8 p -143.29 -171.15 3.43 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.131 -0.486 . . . . 61.14 110.887 -179.858 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 39.4 mm -53.46 141.13 8.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.313 0 CA-C-N 116.146 -0.479 . . . . 75.42 111.094 179.953 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.6 pp0? -174.92 157.29 2.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.142 -0.481 . . . . 64.42 110.955 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -147.02 101.02 0.45 Allowed 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.193 -0.458 . . . . 64.1 111.09 179.992 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 164.1 -144.73 9.69 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.757 -0.735 . . . . 32.33 112.475 179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 9.3 p-10 -113.65 138.35 50.31 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.898 0.38 . . . . 53.14 110.87 -179.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 174.27 -156.09 22.69 Favored Glycine 0 N--CA 1.452 -0.282 0 C-N-CA 120.728 -0.749 . . . . 54.03 112.496 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 46.9 m80 -142.23 178.93 7.22 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.803 0.335 . . . . 74.14 110.851 -179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -103.57 -166.63 25.43 Favored Glycine 0 N--CA 1.451 -0.328 0 C-N-CA 120.688 -0.768 . . . . 43.13 112.486 -179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 12.5 mp0 -130.38 -174.74 3.43 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.83 0.348 . . . . 74.54 110.951 -179.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.5 m -137.38 174.61 10.41 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.246 -0.434 . . . . 72.34 110.836 -179.806 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -104.12 -174.98 2.67 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.125 -0.488 . . . . 71.34 110.954 -179.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.577 ' O ' HD12 ' A' ' 116' ' ' LEU . . . -129.54 -90.72 0.61 Allowed Glycine 0 N--CA 1.452 -0.291 0 C-N-CA 120.706 -0.759 . . . . 51.32 112.497 179.976 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.577 HD12 ' O ' ' A' ' 115' ' ' GLY . 0.4 OUTLIER 33.39 48.16 0.17 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.79 0.329 . . . . 70.21 110.941 -179.936 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 10.6 tm-20 . . . . . 0 C--N 1.33 -0.254 0 CA-C-N 116.152 -0.476 . . . . 75.34 110.897 179.948 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.454 -0.258 . . . . 71.24 112.454 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 20.0 tttm -133.94 -47.35 0.79 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.79 0.329 . . . . 65.01 110.899 -179.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' -7' ' ' PHE . . . . . 0.417 ' HB3' HD12 ' A' ' 49' ' ' LEU . 38.2 m-85 -90.08 -71.8 0.6 Allowed 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.172 -0.467 . . . . 75.34 110.895 179.968 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 19.6 mm 54.65 77.88 0.42 Allowed Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.588 0.709 . . . . 71.31 111.155 179.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.79 87.49 0.56 Allowed 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.688 2.258 . . . . 72.33 112.294 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 33.5 t -104.01 34.17 3.15 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.225 -0.443 . . . . 55.43 110.859 -179.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' -3' ' ' ARG . . . . . 0.43 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 2.5 mtp85 -95.83 161.07 28.7 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.64 0.733 . . . . 74.03 110.852 -179.907 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' -2' ' ' PRO . . . . . 0.43 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.4 Cg_endo -69.73 111.03 2.69 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.671 2.247 . . . . 74.41 112.342 -179.966 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' -1' ' ' ALA . . . . . 0.411 ' HA ' ' HD2' ' B' ' 0' ' ' PRO . . . -50.09 108.2 0.96 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.595 0.712 . . . . 73.11 111.104 179.882 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 0' ' ' PRO . . . . . 0.411 ' HD2' ' HA ' ' B' ' -1' ' ' ALA . 53.6 Cg_endo -69.81 145.69 57.6 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.73 2.287 . . . . 53.22 112.311 -179.954 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 22.6 ttmm -97.3 137.49 21.17 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.536 0.684 . . . . 74.11 110.903 179.927 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 165.67 30.21 Favored 'Trans proline' 0 C--O 1.232 0.178 0 C-N-CA 122.647 2.231 . . . . 72.25 112.379 179.902 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 97.77 0.66 Allowed 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.688 2.259 . . . . 74.23 112.327 -179.998 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 72.7 m -77.05 -61.85 1.85 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.206 -0.452 . . . . 72.14 110.816 -179.824 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 33.4 t -123.28 89.56 3.12 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.096 -0.502 . . . . 64.33 110.863 -179.78 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.307 0 CA-C-N 116.154 -0.475 . . . . 54.21 111.058 179.94 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 17.2 tpt . . . . . 0 C--O 1.231 0.101 0 CA-C-O 120.809 0.338 . . . . 75.23 110.923 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . 0.548 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -156.65 159.86 31.09 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.55 0.69 . . . . 54.14 111.084 179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.548 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.7 Cg_endo -69.78 75.36 1.23 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.653 2.236 . . . . 75.44 112.349 -179.975 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.79 HD11 HG13 ' A' ' 28' ' ' ILE . 0.6 OUTLIER -74.16 140.33 45.09 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.232 -0.44 . . . . 64.53 110.938 179.995 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.78 ' CD2' HD22 ' A' ' 60' ' ' LEU . 16.6 m-30 -117.37 139.43 50.88 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.222 -0.445 . . . . 72.43 110.858 179.977 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -109.7 170.11 8.28 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.154 -0.475 . . . . 72.14 111.093 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 7.2 p -130.95 125.89 58.78 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.273 0 CA-C-N 116.215 -0.448 . . . . 74.31 111.133 179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.745 HG21 ' HB ' ' A' ' 20' ' ' VAL . 0.0 OUTLIER -71.84 135.45 46.62 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.206 -0.452 . . . . 65.33 111.14 -179.935 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.466 HD11 ' HB2' ' A' ' 56' ' ' ARG . 40.3 mt -105.56 -16.34 14.74 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.246 -0.434 . . . . 61.44 110.89 179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 41.8 m-85 -138.39 158.3 44.55 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.19 -0.459 . . . . 74.2 110.912 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -84.27 104.74 14.56 Favored 'General case' 0 C--N 1.33 -0.259 0 CA-C-N 116.07 -0.514 . . . . 52.14 110.875 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 72.1 t80 -97.17 123.36 40.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.131 -0.486 . . . . 74.1 110.846 -179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -98.73 121.13 40.28 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.133 -0.485 . . . . 73.1 110.892 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.58 ' HB1' ' HB3' ' A' ' 17' ' ' GLU . . . -63.46 164.9 8.55 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.223 -0.444 . . . . 71.24 111.09 179.853 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 1.1 pt-20 -116.44 -29.49 6.16 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.21 -0.45 . . . . 62.13 110.899 -179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.9 mmm180 -135.89 -176.18 4.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.18 -0.464 . . . . 45.03 110.828 -179.891 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.5 p-10 -63.5 -43.23 97.82 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.144 -0.48 . . . . 70.31 110.858 179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -55.06 -53.15 59.46 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.174 -0.466 . . . . 74.43 110.876 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.58 ' HB3' ' HB1' ' A' ' 12' ' ' ALA . 1.9 tp10 -67.42 149.41 50.28 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.156 -0.474 . . . . 61.12 110.901 -179.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . 0.516 HD22 ' O ' ' A' ' 46' ' ' GLY . 3.1 tp -121.17 154.16 36.6 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.134 -0.484 . . . . 70.41 110.909 -179.951 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.8 t70 -94.34 148.16 22.5 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.186 -0.461 . . . . 72.22 110.862 179.819 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.745 ' HB ' HG21 ' A' ' 6' ' ' THR . 0.1 OUTLIER -144.4 159.22 15.11 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.226 -0.443 . . . . 64.3 111.133 179.977 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -124.51 157.0 66.79 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.675 0.75 . . . . 71.31 110.861 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 117.68 5.23 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.726 2.284 . . . . 64.22 112.309 179.979 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 107.93 5.2 33.42 Favored Glycine 0 N--CA 1.452 -0.28 0 C-N-CA 120.68 -0.771 . . . . 71.23 112.481 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -91.84 151.67 20.47 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.819 0.342 . . . . 64.34 110.905 -179.837 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -100.69 113.36 26.17 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.201 -0.454 . . . . 72.52 110.878 -179.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.702 ' HB3' ' HB1' ' A' ' 39' ' ' ALA . 4.1 mp -112.33 168.22 9.81 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.15 -0.477 . . . . 74.12 110.949 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 2.9 t -121.52 116.15 24.15 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.2 -0.455 . . . . 43.04 110.843 -179.936 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.79 HG13 HD11 ' A' ' 2' ' ' LEU . 27.9 mm -68.55 147.63 12.18 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.155 -0.475 . . . . 63.34 111.101 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 27.7 m -125.43 -37.05 2.4 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.157 -0.474 . . . . 74.14 110.875 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -170.25 171.76 6.59 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.195 -0.457 . . . . 52.41 111.123 179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . 0.533 ' O ' HG22 ' A' ' 88' ' ' THR . 2.9 p80 -126.44 175.45 7.87 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.231 -0.44 . . . . 72.23 110.844 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . . . . . . . . . 30.4 t80 -147.01 102.17 3.49 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.221 -0.445 . . . . 74.22 110.927 -179.867 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 60.9 18.18 8.54 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.112 -0.495 . . . . 64.21 110.85 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.581 ' CD2' HD12 ' A' ' 81' ' ' ILE . 43.9 m-85 62.1 19.82 11.15 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.177 -0.465 . . . . 63.53 110.931 -179.844 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 1.8 pt-20 -119.03 -4.24 10.61 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.081 -0.509 . . . . 75.13 110.833 -179.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.432 ' HB3' HD21 ' A' ' 49' ' ' LEU . 79.3 m95 -150.01 135.7 18.4 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.139 -0.482 . . . . 74.21 110.878 -179.932 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.62 ' HD2' HG22 ' A' ' 52' ' ' VAL . 0.3 OUTLIER -121.9 144.91 48.57 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.195 -0.457 . . . . 74.4 110.842 -179.944 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 11.7 mm -103.51 94.88 3.43 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.291 0 CA-C-N 116.136 -0.483 . . . . 75.43 111.141 179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.702 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.19 139.49 45.29 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.19 -0.459 . . . . 64.14 111.123 179.777 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 13.1 pttp -115.33 157.11 44.73 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.547 0.689 . . . . 64.45 110.918 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.76 108.39 2.07 Favored 'Trans proline' 0 C--N 1.341 0.155 0 C-N-CA 122.664 2.242 . . . . 72.41 112.328 179.932 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.416 HD11 ' CG ' ' A' ' 3' ' ' PHE . 62.3 mt -68.71 -26.88 34.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.323 0 CA-C-N 116.217 -0.447 . . . . 70.03 111.156 179.888 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' A ASN . . . . . . . . . . . . . 29.1 m-20 -87.16 -60.86 1.86 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.131 -0.486 . . . . 73.32 110.895 179.961 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' B ARG . . . . . . . . . . . . . 33.0 mtp180 -60.75 -169.59 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.183 -0.462 . . . . 53.13 110.86 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 65.0 mt -83.72 -174.46 5.3 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.217 -0.447 . . . . 64.35 110.9 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -62.94 111.32 3.99 Favored Glycine 0 N--CA 1.452 -0.292 0 C-N-CA 120.741 -0.743 . . . . 74.5 112.503 179.875 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . 0.516 ' O ' HD22 ' A' ' 18' ' ' LEU . . . -152.03 66.66 0.34 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.726 -0.75 . . . . 64.34 112.467 -179.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 124.94 11.59 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.708 2.272 . . . . 64.15 112.331 -179.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -128.85 -136.93 4.24 Favored Glycine 0 N--CA 1.45 -0.375 0 C-N-CA 120.756 -0.735 . . . . 75.24 112.485 179.986 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.507 HD12 ' HB3' ' B' ' -7' ' ' PHE . 1.0 OUTLIER -144.86 126.87 15.51 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.869 0.366 . . . . 65.12 110.876 -179.94 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.421 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.3 p -140.53 132.8 14.4 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.617 0.722 . . . . 54.11 111.107 179.861 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.421 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.8 Cg_endo -69.78 151.04 68.84 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.683 2.255 . . . . 75.2 112.37 179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.74 HG12 ' HB ' ' A' ' 71' ' ' THR . 15.9 t -61.97 -21.67 26.8 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.243 -0.435 . . . . 73.44 111.133 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 5.9 t -77.56 -4.11 44.11 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.166 -0.47 . . . . 34.42 110.856 -179.841 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -122.45 15.21 10.4 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.123 -0.489 . . . . 72.24 110.92 -179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 21.8 m -151.42 156.33 6.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.144 -0.48 . . . . 60.21 111.084 179.935 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.466 ' HB2' HD11 ' A' ' 7' ' ' LEU . 21.1 ttm180 -125.52 124.56 41.59 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.161 -0.472 . . . . 74.23 110.865 -179.987 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.505 HG21 HG21 ' A' ' 80' ' ' ILE . 40.7 mm -74.72 108.98 6.86 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.315 0 CA-C-N 116.223 -0.444 . . . . 73.01 111.143 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.461 HG23 ' HG2' ' A' ' 56' ' ' ARG . 1.1 pt -126.45 167.93 20.23 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.347 0 CA-C-N 116.16 -0.473 . . . . 73.5 111.176 179.879 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.2 t0 -107.89 119.72 40.26 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.206 -0.452 . . . . 75.24 110.88 179.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.78 HD22 ' CD2' ' A' ' 3' ' ' PHE . 0.1 OUTLIER -50.78 -30.83 15.13 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.215 -0.448 . . . . 65.41 110.877 -179.93 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.442 ' HE2' ' HG ' ' A' ' 60' ' ' LEU . 2.8 mtm -81.72 -34.75 30.38 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.218 -0.446 . . . . 64.34 110.898 179.843 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 5.2 t0 -141.02 76.3 22.46 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.596 0.712 . . . . 75.21 110.818 179.953 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.741 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.3 Cg_endo -69.84 -7.84 22.08 Favored 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.707 2.271 . . . . 63.14 112.303 -179.958 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.77 -12.37 25.47 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 55.34 111.095 179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 17.9 ttmt -84.31 -51.06 7.28 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.261 -0.427 . . . . 73.15 110.917 179.951 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.552 ' O ' HG12 ' A' ' 69' ' ' VAL . 43.9 m-85 -94.98 23.25 5.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.175 -0.466 . . . . 73.13 110.935 -179.953 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.741 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -86.57 -18.16 32.18 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.103 -0.498 . . . . 75.44 111.136 179.856 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 9.6 p -93.18 -16.07 25.26 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.206 -0.452 . . . . 71.01 110.882 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.755 HG21 HD11 ' A' ' 80' ' ' ILE . 9.9 p -51.08 144.36 2.29 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.118 -0.492 . . . . 72.34 111.126 179.949 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 26.7 m-20 -103.78 86.5 2.62 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.166 -0.47 . . . . 75.41 110.844 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.74 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -51.71 -29.95 20.35 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.211 -0.45 . . . . 75.13 111.142 -179.887 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -59.41 -47.99 83.37 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 75.32 110.905 -179.904 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -64.05 112.22 2.88 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.155 -0.475 . . . . 71.41 110.856 179.937 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.66 -26.68 34.79 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.182 -0.463 . . . . 63.23 110.877 -179.909 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.9 mt-10 -66.33 -49.59 66.46 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.202 -0.454 . . . . 74.11 110.921 -179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 3.1 mm100 -61.74 -56.07 23.54 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.146 -0.479 . . . . 74.34 110.931 -179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.519 ' HA ' HD12 ' A' ' 80' ' ' ILE . 0.5 OUTLIER -55.69 -30.83 27.84 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.298 0 CA-C-N 116.163 -0.471 . . . . 72.41 111.134 179.951 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 8.3 mtm -67.83 -56.89 7.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.177 -0.465 . . . . 72.13 110.876 179.928 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 44.4 mttt -57.36 -36.3 71.05 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.228 -0.442 . . . . 72.54 110.942 179.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.755 HD11 HG21 ' A' ' 69' ' ' VAL . 24.7 mt -65.72 -51.38 62.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.23 -0.441 . . . . 65.3 111.116 179.901 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.752 HG23 ' HB ' ' A' ' 86' ' ' ILE . 95.9 mt -61.03 -34.79 61.42 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.13 -0.486 . . . . 75.45 111.145 179.849 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 12.3 t70 -71.19 -47.29 58.42 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.154 -0.476 . . . . 74.32 110.858 179.884 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -66.47 -45.68 78.9 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.199 -0.455 . . . . 73.22 110.927 -179.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 13.2 m-85 -73.98 -10.33 59.53 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.142 -0.481 . . . . 73.42 110.839 -179.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 58.36 44.37 18.49 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.131 -0.486 . . . . 74.24 110.935 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.752 ' HB ' HG23 ' A' ' 81' ' ' ILE . 16.1 mt -77.25 120.3 81.0 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.597 0.713 . . . . 73.41 111.16 179.886 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.83 166.63 27.04 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.685 2.257 . . . . 72.11 112.311 179.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . 0.533 HG22 ' O ' ' A' ' 31' ' ' HIS . 0.0 OUTLIER -90.66 169.96 10.55 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.226 -0.443 . . . . 74.31 111.149 -179.971 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 94.7 t -51.42 -57.73 2.87 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.258 0 CA-C-N 116.207 -0.451 . . . . 74.01 111.138 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -51.35 -44.27 62.03 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.203 -0.453 . . . . 75.23 110.887 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 71.0 mm-40 -62.19 -46.26 89.73 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.13 -0.486 . . . . 71.55 110.952 -179.972 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 27.2 t90 -61.13 -40.13 92.64 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.229 -0.441 . . . . 72.24 110.951 -179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.6 mmpt? -64.15 -51.68 62.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 72.31 110.929 179.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 8.9 t70 -58.84 -39.5 81.46 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.221 -0.445 . . . . 65.41 110.883 179.842 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 34.6 mt-30 -62.7 -53.58 52.26 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.15 -0.477 . . . . 74.13 110.891 -179.893 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -62.58 -38.73 91.23 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.22 -0.446 . . . . 74.34 111.166 -179.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 24.9 mmt180 -62.44 -59.34 5.11 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.255 -0.429 . . . . 75.33 110.867 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 27.4 ptt180 -60.29 -32.39 71.16 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.208 -0.451 . . . . 62.54 110.823 -179.906 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 69.1 t80 -65.19 -47.04 78.34 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.216 -0.447 . . . . 73.24 110.935 -179.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.18 -25.55 68.39 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 116.142 -0.481 . . . . 74.44 110.909 179.935 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 10.9 mm-40 -104.73 -176.44 3.08 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.223 -0.444 . . . . 75.1 110.85 179.957 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 2.1 t -129.68 151.15 50.59 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.107 -0.497 . . . . 75.03 110.854 -179.79 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 61.3 p -124.75 -174.24 2.98 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.102 -0.499 . . . . 71.52 110.857 -179.789 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 23.1 mm -67.8 -21.86 27.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.146 -0.479 . . . . 71.11 111.165 179.945 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -92.42 174.12 7.45 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.164 -0.471 . . . . 75.3 110.875 179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -147.58 160.68 8.0 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.319 0 CA-C-N 116.22 -0.446 . . . . 73.52 111.15 179.97 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 82.58 167.1 39.94 Favored Glycine 0 N--CA 1.451 -0.355 0 C-N-CA 120.731 -0.747 . . . . 54.24 112.552 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 81.6 m-20 -113.92 141.27 47.58 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.94 0.4 . . . . 63.05 110.868 -179.88 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -77.06 100.79 1.52 Allowed Glycine 0 N--CA 1.451 -0.357 0 C-N-CA 120.703 -0.761 . . . . 74.53 112.481 179.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -151.35 136.27 17.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.804 0.335 . . . . 64.42 110.882 -179.946 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -135.95 171.53 22.7 Favored Glycine 0 N--CA 1.45 -0.381 0 C-N-CA 120.746 -0.74 . . . . 53.3 112.542 -179.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 4.9 pt20 -110.42 -179.6 3.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.83 0.348 . . . . 65.23 110.88 -179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.5 p -135.91 167.34 21.38 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 64.23 110.846 -179.787 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 18.9 pt20 -165.51 139.05 4.53 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.078 -0.51 . . . . 72.43 110.894 -179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.574 ' C ' HD12 ' A' ' 116' ' ' LEU . . . -133.45 21.64 4.03 Favored Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.779 -0.724 . . . . 63.15 112.493 -179.984 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.574 HD12 ' C ' ' A' ' 115' ' ' GLY . 1.7 mp 52.15 37.25 21.24 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.799 0.333 . . . . 65.33 110.903 -179.967 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 . . . . . 0 C--N 1.33 -0.266 0 CA-C-N 116.201 -0.454 . . . . 75.44 110.892 179.909 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.335 0 N-CA-C 112.479 -0.248 . . . . 61.22 112.479 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.09 6.11 5.38 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.834 0.349 . . . . 65.12 110.935 179.99 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' -7' ' ' PHE . . . . . 0.507 ' HB3' HD12 ' A' ' 49' ' ' LEU . 39.4 m-85 -95.31 -76.83 0.48 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.233 -0.44 . . . . 73.43 110.888 179.98 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' -6' ' ' ILE . . . . . . . . . . . . . 12.8 mm 49.1 78.35 0.41 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.577 0.703 . . . . 70.14 111.165 179.982 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.72 82.37 0.75 Allowed 'Trans proline' 0 C--N 1.341 0.148 0 C-N-CA 122.692 2.261 . . . . 72.41 112.377 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -90.68 47.84 1.47 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.254 -0.43 . . . . 71.21 110.88 -179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' -3' ' ' ARG . . . . . 0.433 ' HB3' ' HD2' ' B' ' -2' ' ' PRO . 0.2 OUTLIER -105.13 163.21 17.62 Favored Pre-proline 0 C--N 1.328 -0.336 0 CA-C-O 121.645 0.736 . . . . 72.23 110.851 -179.91 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' -2' ' ' PRO . . . . . 0.433 ' HD2' ' HB3' ' B' ' -3' ' ' ARG . 53.9 Cg_endo -69.76 -5.98 17.5 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.684 2.256 . . . . 73.54 112.332 179.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' -1' ' ' ALA . . . . . 0.418 ' HA ' ' HD2' ' B' ' 0' ' ' PRO . . . 51.22 89.4 0.1 OUTLIER Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.543 0.687 . . . . 75.13 111.094 179.855 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 0' ' ' PRO . . . . . 0.418 ' HD2' ' HA ' ' B' ' -1' ' ' ALA . 54.1 Cg_endo -69.74 129.63 17.95 Favored 'Trans proline' 0 C--O 1.231 0.151 0 C-N-CA 122.705 2.27 . . . . 41.32 112.36 -179.993 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -70.6 160.44 81.65 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.585 0.707 . . . . 63.15 110.901 179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 166.39 27.79 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.693 2.262 . . . . 74.0 112.353 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 115.82 4.27 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.65 2.233 . . . . 63.4 112.346 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 38.7 t -119.25 58.3 0.87 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.226 -0.443 . . . . 34.11 110.858 -179.849 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 19.7 m -53.8 132.79 42.08 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.083 -0.508 . . . . 65.44 110.868 -179.845 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.137 -0.483 . . . . 30.02 111.072 179.908 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 4.7 ppp? . . . . . 0 C--O 1.231 0.087 0 CA-C-O 120.778 0.323 . . . . 71.23 110.902 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . 0.576 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -80.49 160.16 68.0 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.604 0.716 . . . . 73.23 111.086 179.916 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.576 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 53.5 Cg_endo -69.76 97.43 0.64 Allowed 'Trans proline' 0 C--O 1.232 0.193 0 C-N-CA 122.733 2.289 . . . . 71.15 112.287 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 1.5 pp -100.18 139.27 36.09 Favored 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.224 -0.443 . . . . 63.14 110.899 179.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 10.3 m-85 -122.47 163.11 20.45 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.208 -0.451 . . . . 62.01 110.884 179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . 0.434 ' HB2' HD11 ' A' ' 28' ' ' ILE . . . -135.02 163.39 29.97 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.16 -0.473 . . . . 41.42 111.117 179.931 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.475 HG12 HG12 ' A' ' 58' ' ' ILE . 7.5 p -127.43 124.95 64.85 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.28 0 CA-C-N 116.19 -0.459 . . . . 51.1 111.092 179.994 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.766 HG21 HG11 ' A' ' 20' ' ' VAL . 0.0 OUTLIER -68.72 145.67 53.62 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.194 -0.457 . . . . 55.23 111.117 -179.999 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.632 HD11 ' HB2' ' A' ' 56' ' ' ARG . 15.7 mt -114.46 -13.74 12.2 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.212 -0.449 . . . . 74.25 110.857 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 47.9 m-85 -138.33 170.22 16.4 Favored 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 116.185 -0.461 . . . . 73.14 110.931 -179.988 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -92.68 104.92 17.15 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.155 -0.475 . . . . 73.2 110.881 -179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . 0.497 ' HB3' HG12 ' A' ' 20' ' ' VAL . 26.8 t80 -86.9 104.48 16.27 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.153 -0.476 . . . . 72.31 110.868 -179.905 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 17.8 mttp -80.92 101.03 9.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.127 -0.488 . . . . 72.44 110.918 179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -52.15 141.76 17.92 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.216 -0.447 . . . . 74.11 111.089 179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -111.68 -28.76 7.98 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.203 -0.453 . . . . 71.51 110.85 -179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 34.0 mmt180 -127.11 -178.11 4.3 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.148 -0.478 . . . . 63.11 110.854 -179.851 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -66.95 -37.33 84.09 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.202 -0.454 . . . . 74.21 110.888 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 3.0 p-10 -67.91 -30.23 69.5 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.184 -0.462 . . . . 70.3 110.856 179.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -81.6 135.03 35.56 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.236 -0.438 . . . . 71.54 110.883 -179.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 5.9 tp -108.11 150.12 27.61 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.127 -0.488 . . . . 73.33 110.921 -179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 47.5 t0 -91.73 123.26 34.99 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.185 -0.461 . . . . 62.41 110.868 179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.838 HG21 HD11 ' A' ' 26' ' ' LEU . 9.2 p -133.09 156.63 42.34 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.272 0 CA-C-N 116.201 -0.454 . . . . 73.41 111.095 179.968 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -114.93 158.55 40.41 Favored Pre-proline 0 C--N 1.33 -0.276 0 CA-C-O 121.709 0.766 . . . . 74.11 110.808 -179.827 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 118.71 5.85 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.71 2.273 . . . . 64.14 112.341 179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 106.04 -1.41 38.21 Favored Glycine 0 N--CA 1.452 -0.297 0 C-N-CA 120.721 -0.752 . . . . 74.51 112.485 179.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 19.2 mm-40 -83.83 162.24 20.64 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.828 0.347 . . . . 75.24 110.92 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . 0.418 ' CB ' HD12 ' A' ' 42' ' ' ILE . 6.4 m120 -100.76 132.32 46.22 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.168 -0.469 . . . . 75.42 110.847 -179.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.838 HD11 HG21 ' A' ' 20' ' ' VAL . 15.2 mt -129.47 151.71 49.8 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.106 -0.497 . . . . 74.12 110.902 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -109.69 112.82 25.11 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.172 -0.467 . . . . 74.32 110.908 -179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.434 HD11 ' HB2' ' A' ' 4' ' ' ALA . 56.3 mt -80.67 144.44 10.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.339 0 CA-C-N 116.141 -0.481 . . . . 75.41 111.139 179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.5 m -117.11 -39.96 3.16 Favored 'General case' 0 C--N 1.328 -0.368 0 CA-C-N 116.193 -0.458 . . . . 45.52 110.856 179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.543 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -163.28 173.76 12.92 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.202 -0.454 . . . . 52.32 111.056 -179.991 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -119.97 177.96 4.79 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.185 -0.461 . . . . 73.44 110.819 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.716 ' CE2' HG23 ' B' ' -6' ' ' ILE . 49.8 t80 -148.2 101.17 3.24 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.176 -0.466 . . . . 71.14 110.912 -179.849 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER 60.15 18.05 7.44 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.176 -0.466 . . . . 53.45 110.862 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.611 ' HD2' HD12 ' A' ' 81' ' ' ILE . 39.1 m-85 61.61 20.62 11.44 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 116.23 -0.441 . . . . 75.02 110.925 -179.865 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -118.25 -9.33 10.46 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.11 -0.496 . . . . 51.31 110.879 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.411 ' HB3' HD21 ' A' ' 49' ' ' LEU . 80.6 m95 -149.23 135.81 19.44 Favored 'General case' 0 C--N 1.327 -0.381 0 CA-C-N 116.15 -0.477 . . . . 74.33 110.944 179.99 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.642 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -116.45 130.23 56.65 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.237 -0.438 . . . . 75.15 110.907 -179.964 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.7 mm -83.54 95.1 3.56 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.141 -0.481 . . . . 61.42 111.136 179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.559 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -110.87 149.61 30.35 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 42.43 111.114 179.805 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 8.9 pttp -125.04 157.22 67.7 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.555 0.693 . . . . 72.34 110.935 179.946 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 135.97 31.7 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.642 2.228 . . . . 74.44 112.335 179.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.418 HD12 ' CB ' ' A' ' 25' ' ' ASN . 57.2 mt -98.69 -22.98 4.64 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.23 -0.441 . . . . 71.13 111.167 179.896 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' A ASN . . . . . . . . . . . . . 2.6 m120 -88.39 -69.64 0.69 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.139 -0.482 . . . . 71.22 110.897 179.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' B ARG . . . . . . . . . . . . . 10.9 ptp180 -66.15 162.65 19.3 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.173 -0.467 . . . . 74.44 110.875 -179.975 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -105.49 13.9 29.43 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.154 -0.475 . . . . 73.52 110.899 -179.942 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . -51.17 -88.0 0.01 OUTLIER Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.714 -0.755 . . . . 60.32 112.484 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 176.5 170.7 39.41 Favored Glycine 0 N--CA 1.451 -0.317 0 C-N-CA 120.715 -0.755 . . . . 33.21 112.481 -179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 148.81 65.71 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.647 2.231 . . . . 63.33 112.318 -179.937 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.5 -141.93 4.55 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.705 -0.76 . . . . 65.21 112.485 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.602 HD11 ' HD3' ' B' ' -5' ' ' PRO . 0.7 OUTLIER -146.24 131.26 18.24 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.828 0.347 . . . . 44.43 110.939 -179.941 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.435 HG23 ' HD2' ' A' ' 51' ' ' PRO . 7.5 p -142.41 133.58 12.93 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.606 0.717 . . . . 72.34 111.196 179.823 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.435 ' HD2' HG23 ' A' ' 50' ' ' VAL . 54.0 Cg_endo -69.76 152.69 69.39 Favored 'Trans proline' 0 C--N 1.341 0.156 0 C-N-CA 122.649 2.233 . . . . 74.11 112.309 179.985 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.793 HG12 ' HB ' ' A' ' 71' ' ' THR . 13.1 t -64.85 -21.75 30.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.174 -0.467 . . . . 70.11 111.145 179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 12.4 t -77.09 -3.07 37.37 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.156 -0.474 . . . . 74.34 110.863 -179.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 32.0 m-85 -125.09 18.22 8.42 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.118 -0.492 . . . . 63.44 110.878 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.583 HG22 ' HA ' ' A' ' 52' ' ' VAL . 13.6 m -148.96 159.86 5.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.295 0 CA-C-N 116.127 -0.488 . . . . 72.52 111.077 179.898 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.632 ' HB2' HD11 ' A' ' 7' ' ' LEU . 18.4 ttm180 -127.28 112.31 14.92 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.157 -0.474 . . . . 75.44 110.894 179.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 35.2 mm -64.66 114.14 2.22 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.459 . . . . 73.52 111.11 179.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.509 HG23 ' HG2' ' A' ' 56' ' ' ARG . 1.5 pt -133.52 137.69 52.43 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.338 0 CA-C-N 116.153 -0.476 . . . . 74.14 111.177 179.809 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -75.13 122.23 23.28 Favored 'General case' 0 C--N 1.328 -0.359 0 CA-C-N 116.163 -0.471 . . . . 75.44 110.877 179.863 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 3.4 mt -52.02 -32.79 35.6 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.157 -0.474 . . . . 73.21 110.93 -179.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 8.5 mmt -83.06 -29.16 29.04 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.156 -0.474 . . . . 75.5 110.845 179.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -145.3 78.95 11.91 Favored Pre-proline 0 C--N 1.328 -0.359 0 CA-C-O 121.618 0.723 . . . . 75.03 110.905 179.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.752 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 53.4 Cg_endo -69.78 -7.73 21.82 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.678 2.252 . . . . 73.11 112.306 -179.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -95.15 -7.89 37.96 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.258 -0.428 . . . . 63.33 111.123 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 3.4 mtpt -84.12 -52.11 6.54 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.182 -0.463 . . . . 63.42 110.9 179.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.615 ' O ' HG12 ' A' ' 69' ' ' VAL . 12.7 m-85 -97.64 23.73 7.49 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.204 -0.453 . . . . 74.32 110.941 -179.949 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.752 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -84.88 -17.06 39.08 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.088 -0.505 . . . . 33.42 111.053 179.906 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 38.0 m -97.87 -18.36 18.75 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.223 -0.444 . . . . 61.23 110.856 -179.783 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.896 HG21 HD11 ' A' ' 80' ' ' ILE . 7.3 p -51.2 144.84 2.13 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.277 0 CA-C-N 116.105 -0.498 . . . . 75.11 111.127 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 3.7 m-20 -99.14 87.28 3.63 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.133 -0.485 . . . . 60.32 110.908 179.871 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.793 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.2 OUTLIER -51.92 -34.62 42.39 Favored 'General case' 0 C--N 1.33 -0.278 0 CA-C-N 116.207 -0.452 . . . . 73.22 111.203 -179.875 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 8.3 t80 -58.22 -45.02 88.44 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.212 -0.449 . . . . 75.13 110.937 -179.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -63.5 109.14 1.54 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.115 -0.493 . . . . 73.52 110.921 179.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -54.61 -26.24 31.55 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.228 -0.442 . . . . 60.11 110.868 -179.88 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -67.01 -52.85 37.32 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.192 -0.458 . . . . 73.13 110.895 -179.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -60.99 -56.42 21.34 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.149 -0.478 . . . . 72.41 110.931 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.576 HG21 HG11 ' A' ' 52' ' ' VAL . 1.5 p -53.7 -31.49 20.07 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.178 -0.464 . . . . 73.3 111.135 179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 12.3 mtm -68.06 -56.54 8.53 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.187 -0.461 . . . . 75.22 110.86 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 33.1 mttt -55.05 -37.42 66.68 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.19 -0.459 . . . . 75.42 110.891 179.968 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.896 HD11 HG21 ' A' ' 69' ' ' VAL . 48.0 mt -66.32 -52.67 44.61 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.251 -0.431 . . . . 73.41 111.157 179.86 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.733 HG23 ' HB ' ' A' ' 86' ' ' ILE . 96.5 mt -61.96 -35.8 70.36 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.196 -0.456 . . . . 72.31 111.133 179.857 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 13.9 t0 -69.9 -47.66 61.65 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.139 -0.482 . . . . 45.22 110.853 179.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 44.3 mm-40 -64.25 -49.25 72.65 Favored 'General case' 0 C--N 1.33 -0.26 0 CA-C-N 116.183 -0.462 . . . . 75.54 110.883 -179.906 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 14.2 m-85 -68.04 -14.71 63.18 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.173 -0.467 . . . . 73.33 110.907 -179.948 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.5 mmtp 60.46 55.81 3.34 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.126 -0.488 . . . . 72.42 110.941 179.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.733 ' HB ' HG23 ' A' ' 81' ' ' ILE . 31.4 mt -88.41 126.09 61.45 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.623 0.725 . . . . 70.3 111.159 179.848 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.543 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 54.1 Cg_endo -69.73 163.8 36.9 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.709 2.273 . . . . 64.04 112.361 179.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -95.95 172.11 8.21 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.206 -0.452 . . . . 62.2 111.132 -179.959 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . 0.413 HG23 ' HB2' ' A' ' 32' ' ' TYR . 88.2 t -51.34 -54.31 12.06 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.281 0 CA-C-N 116.209 -0.451 . . . . 74.32 111.117 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 19.5 mt-10 -50.5 -47.5 57.26 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 116.172 -0.467 . . . . 73.35 110.888 -179.974 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 45.4 mm-40 -62.96 -41.89 99.66 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.096 -0.502 . . . . 72.12 110.899 -179.908 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 24.2 t90 -65.19 -39.99 93.59 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.2 -0.454 . . . . 74.23 110.94 -179.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -64.82 -49.54 70.23 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.276 -0.42 . . . . 70.51 110.916 179.907 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 23.3 t0 -63.16 -37.73 88.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.253 -0.43 . . . . 71.13 110.89 179.845 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 33.9 mt-30 -63.49 -52.04 63.01 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.181 -0.463 . . . . 73.24 110.915 -179.928 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -60.98 -43.89 98.17 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.171 -0.468 . . . . 72.34 111.117 -179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 8.9 mmt-85 -58.34 -57.69 11.79 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.449 . . . . 73.33 110.868 -179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 29.7 ptt180 -62.72 -28.43 69.95 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 72.12 110.892 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 37.4 t80 -66.61 -45.97 77.4 Favored 'General case' 0 C--N 1.327 -0.371 0 CA-C-N 116.219 -0.446 . . . . 75.44 110.873 -179.841 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 9.1 mtpp -57.23 -25.78 59.67 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.141 -0.481 . . . . 73.13 110.91 179.895 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 73.1 mm-40 -65.8 -172.52 0.13 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.217 -0.447 . . . . 54.34 110.846 179.999 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER 55.81 36.04 26.51 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.11 -0.495 . . . . 53.41 110.858 -179.792 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 63.1 m -61.13 129.6 42.16 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.102 -0.499 . . . . 64.31 110.876 -179.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . 0.58 ' O ' HG22 ' A' ' 104' ' ' ILE . 16.7 mt 69.62 21.2 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.336 0 CA-C-N 116.191 -0.458 . . . . 64.32 111.101 179.917 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -128.6 -169.61 2.11 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.217 -0.447 . . . . 70.23 110.94 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . . . . . . . . . 2.3 mp -130.16 -63.97 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-N 116.233 -0.44 . . . . 74.25 111.11 179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 78.11 -139.22 22.37 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.731 -0.747 . . . . 62.22 112.51 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -111.32 146.38 37.16 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.877 0.37 . . . . 71.34 110.925 -179.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . 154.51 -30.74 0.69 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.77 -0.729 . . . . 73.04 112.519 180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 2.6 t60 -81.42 -43.66 18.62 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.893 0.378 . . . . 72.1 110.855 -179.947 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . 67.29 -138.87 34.86 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.744 -0.741 . . . . 51.4 112.474 -179.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 2.1 pt20 -134.89 169.19 17.76 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.776 0.322 . . . . 71.33 110.945 -179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 12.9 m -110.37 -176.96 3.12 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.233 -0.44 . . . . 61.4 110.853 -179.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 23.0 mm100 -87.9 -65.95 0.96 Allowed 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.112 -0.495 . . . . 74.13 110.908 -179.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . . . . . . . . . . . 72.67 100.55 0.07 OUTLIER Glycine 0 N--CA 1.451 -0.346 0 C-N-CA 120.771 -0.728 . . . . 42.51 112.515 -179.973 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . . . . . . . . . 63.9 mt -94.93 -176.75 3.94 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-O 120.768 0.318 . . . . 72.43 110.938 -179.938 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 4.4 pt-20 . . . . . 0 C--N 1.33 -0.281 0 CA-C-N 116.195 -0.457 . . . . 65.35 110.842 179.954 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.326 0 N-CA-C 112.46 -0.256 . . . . 75.02 112.46 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -160.41 -61.69 0.06 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.808 0.337 . . . . 62.21 110.919 179.989 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -85.64 -80.25 0.22 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.176 -0.466 . . . . 65.52 110.87 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' -6' ' ' ILE . . . . . 0.716 HG23 ' CE2' ' A' ' 32' ' ' TYR . 58.1 mt 45.46 84.47 0.19 Allowed Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.638 0.732 . . . . 75.32 111.099 179.93 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' -5' ' ' PRO . . . . . 0.602 ' HD3' HD11 ' A' ' 49' ' ' LEU . 53.8 Cg_endo -69.79 127.51 14.67 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.666 2.244 . . . . 64.21 112.339 179.89 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER -114.03 0.73 14.43 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.239 -0.437 . . . . 75.51 110.874 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 7.8 mpt_? -50.63 163.82 0.45 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.635 0.731 . . . . 64.13 110.849 -179.888 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -16.22 37.45 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.651 2.234 . . . . 53.1 112.377 179.976 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 64.1 84.65 0.18 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.549 0.69 . . . . 70.33 111.12 179.86 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 138.02 36.94 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.679 2.253 . . . . 65.42 112.351 -179.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 8.5 mptt -71.4 160.69 81.81 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.572 0.701 . . . . 73.31 110.895 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 167.6 24.0 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.635 2.223 . . . . 64.55 112.33 179.9 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.72 -25.32 28.88 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.66 2.24 . . . . 65.51 112.382 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 50.0 m -80.32 68.34 6.45 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.179 -0.464 . . . . 75.14 110.847 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 49.2 m -104.21 -40.43 6.14 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.114 -0.493 . . . . 61.43 110.85 -179.816 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.319 0 CA-C-N 116.123 -0.49 . . . . 64.44 111.107 179.914 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' -2' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.084 0 CA-C-O 120.79 0.329 . . . . 72.32 110.853 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' -1' ' ' ALA . . . . . 0.569 ' HB1' ' HD2' ' A' ' 1' ' ' PRO . . . -133.96 160.43 68.58 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.596 0.712 . . . . 63.21 111.08 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' PRO . . . . . 0.569 ' HD2' ' HB1' ' A' ' -1' ' ' ALA . 54.1 Cg_endo -69.87 119.82 6.69 Favored 'Trans proline' 0 C--O 1.232 0.198 0 C-N-CA 122.662 2.241 . . . . 74.33 112.355 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . 0.649 HD11 HG13 ' A' ' 28' ' ' ILE . 0.5 OUTLIER -117.49 156.18 28.45 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.193 -0.458 . . . . 75.13 110.907 -179.987 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.699 ' CG ' HD23 ' A' ' 60' ' ' LEU . 50.1 m-85 -129.8 161.49 30.62 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.164 -0.471 . . . . 71.01 110.874 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' ALA . . . . . . . . . . . . . . . -136.39 161.64 35.25 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.194 -0.457 . . . . 72.3 111.09 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.463 HG12 HG12 ' A' ' 58' ' ' ILE . 8.7 p -130.76 128.07 62.51 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.316 0 CA-C-N 116.174 -0.466 . . . . 64.31 111.104 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.734 HG21 HG11 ' A' ' 20' ' ' VAL . 0.6 OUTLIER -74.32 139.63 44.31 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.173 -0.467 . . . . 73.2 111.153 179.988 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.792 HD11 ' HB2' ' A' ' 56' ' ' ARG . 9.9 mt -114.9 -15.4 11.83 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.209 -0.45 . . . . 75.0 110.866 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -135.07 158.2 44.98 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.224 -0.444 . . . . 74.31 110.918 179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' GLU . . . . . . . . . . . . . 1.7 tp10 -84.38 105.14 14.98 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 116.088 -0.506 . . . . 74.4 110.878 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -88.31 117.98 27.61 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 71.41 110.915 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' LYS . . . . . . . . . . . . . 20.7 mttt -93.47 113.18 25.26 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.162 -0.472 . . . . 71.53 110.845 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.687 ' HB1' ' HB2' ' A' ' 17' ' ' GLU . . . -66.36 156.71 33.76 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 73.51 111.099 179.78 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 9.7 pt-20 -115.66 -28.55 6.73 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.153 -0.476 . . . . 73.1 110.867 -179.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 14.6 mmm180 -133.09 174.55 10.24 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.184 -0.462 . . . . 74.53 110.856 -179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -58.85 -40.99 85.89 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.156 -0.475 . . . . 73.33 110.877 179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 39.9 m-20 -60.32 -25.89 66.14 Favored 'General case' 0 C--N 1.328 -0.36 0 CA-C-N 116.172 -0.467 . . . . 71.31 110.871 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.687 ' HB2' ' HB1' ' A' ' 12' ' ' ALA . 5.9 mm-40 -87.62 139.41 30.56 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.207 -0.452 . . . . 74.2 110.908 -179.909 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 6.3 tp -116.11 123.27 47.45 Favored 'General case' 0 C--N 1.328 -0.355 0 CA-C-N 116.182 -0.463 . . . . 44.03 110.913 -179.998 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ASP . . . . . . . . . . . . . 3.4 t70 -74.26 145.73 43.8 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.184 -0.462 . . . . 71.14 110.874 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.774 HG21 HD11 ' A' ' 26' ' ' LEU . 9.9 p -147.35 156.78 10.1 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.271 0 CA-C-N 116.232 -0.44 . . . . 72.33 111.136 -179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -113.2 158.45 38.11 Favored Pre-proline 0 C--N 1.33 -0.267 0 CA-C-O 121.649 0.738 . . . . 63.45 110.855 -179.838 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 125.32 12.02 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.681 2.254 . . . . 62.52 112.358 179.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 109.16 -6.84 32.49 Favored Glycine 0 N--CA 1.451 -0.329 0 C-N-CA 120.717 -0.754 . . . . 63.43 112.496 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 34.7 mt-10 -87.74 143.99 26.87 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-O 120.855 0.36 . . . . 70.34 110.882 -179.859 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -97.07 120.56 37.64 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.135 -0.484 . . . . 65.32 110.915 -179.975 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' LEU . . . . . 0.774 HD11 HG21 ' A' ' 20' ' ' VAL . 2.9 mp -111.89 157.44 20.64 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.182 -0.463 . . . . 72.22 110.873 179.979 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -100.33 112.85 25.21 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.148 -0.478 . . . . 74.41 110.836 -179.892 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . 0.649 HG13 HD11 ' A' ' 2' ' ' LEU . 29.7 mm -69.68 143.5 14.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.341 0 CA-C-N 116.148 -0.478 . . . . 73.42 111.097 179.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . . . . . . . . . 20.5 m -121.4 -39.7 2.64 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.15 -0.477 . . . . 74.22 110.925 179.925 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.416 ' HB1' ' O ' ' A' ' 87' ' ' PRO . . . -173.89 173.43 3.25 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.156 -0.474 . . . . 72.01 111.105 179.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' HIS . . . . . . . . . . . . . 3.5 p80 -120.87 176.19 5.67 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.236 -0.438 . . . . 63.41 110.876 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' TYR . . . . . 0.747 ' OH ' HG23 ' B' ' -6' ' ' ILE . 29.7 t80 -146.59 101.01 3.42 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.198 -0.455 . . . . 72.11 110.941 -179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . 0.42 ' HB3' ' CG ' ' A' ' 35' ' ' GLU . 38.0 t0 61.44 16.45 7.53 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.117 -0.492 . . . . 64.53 110.903 179.932 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.613 ' HD2' HD12 ' A' ' 81' ' ' ILE . 40.6 m-85 63.76 30.06 14.69 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.199 -0.455 . . . . 72.14 110.908 -179.825 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.42 ' CG ' ' HB3' ' A' ' 33' ' ' ASP . 3.6 pt-20 -132.21 -1.57 3.61 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.158 -0.474 . . . . 72.44 110.906 179.994 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.556 ' HB3' HD21 ' A' ' 49' ' ' LEU . 85.5 m95 -152.75 135.46 15.35 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-N 116.155 -0.475 . . . . 74.42 110.938 -179.939 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PHE . . . . . 0.527 ' CD2' HG22 ' A' ' 52' ' ' VAL . 0.7 OUTLIER -121.72 139.0 54.13 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.289 -0.414 . . . . 72.21 110.886 -179.991 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 12.9 mm -93.31 94.79 4.87 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.318 0 CA-C-N 116.126 -0.488 . . . . 72.13 111.131 180.0 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ALA . . . . . 0.765 ' HB1' ' HB3' ' A' ' 26' ' ' LEU . . . -108.75 134.87 50.88 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.176 -0.466 . . . . 75.22 111.135 179.801 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -109.64 156.53 39.52 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.555 0.693 . . . . 74.3 110.914 -179.999 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 124.17 10.84 Favored 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.691 2.261 . . . . 75.24 112.33 179.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 46.8 mt -90.19 -45.2 15.02 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.276 -0.42 . . . . 65.1 111.102 179.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' A ASN . . . . . . . . . . . . . 18.3 t-20 -74.69 -67.89 0.59 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.195 -0.457 . . . . 73.42 110.888 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' B ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.01 170.64 16.15 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.224 -0.443 . . . . 73.24 110.886 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -108.42 -176.43 3.04 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.162 -0.472 . . . . 63.53 110.885 -179.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 137.48 -93.89 0.22 Allowed Glycine 0 N--CA 1.452 -0.26 0 C-N-CA 120.723 -0.751 . . . . 72.04 112.478 179.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . -177.88 165.71 35.44 Favored Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.751 -0.738 . . . . 64.43 112.511 -179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 144.32 53.38 Favored 'Trans proline' 0 C--N 1.341 0.134 0 C-N-CA 122.683 2.255 . . . . 72.45 112.312 -179.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . -134.22 -158.01 8.38 Favored Glycine 0 N--CA 1.451 -0.312 0 C-N-CA 120.752 -0.737 . . . . 64.43 112.55 179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.556 HD21 ' HB3' ' A' ' 36' ' ' TRP . 1.0 OUTLIER -124.92 125.01 43.27 Favored 'General case' 0 C--N 1.328 -0.346 0 CA-C-O 120.89 0.376 . . . . 71.21 110.915 -179.933 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . 0.5 HG11 ' HB3' ' A' ' 39' ' ' ALA . 7.4 p -131.11 133.74 25.03 Favored Pre-proline 0 C--N 1.33 -0.25 0 CA-C-O 121.626 0.727 . . . . 71.2 111.12 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . 0.461 ' HD2' HG23 ' A' ' 50' ' ' VAL . 53.9 Cg_endo -69.73 153.19 69.36 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.669 2.246 . . . . 72.44 112.365 179.944 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.814 HG12 ' HB ' ' A' ' 71' ' ' THR . 4.6 t -74.39 -21.14 17.38 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.31 0 CA-C-N 116.203 -0.453 . . . . 71.35 111.151 179.926 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' SER . . . . . . . . . . . . . 50.9 m -76.59 -3.28 36.83 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.183 -0.462 . . . . 74.42 110.852 -179.879 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 23.3 m-85 -125.97 21.29 7.54 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.148 -0.478 . . . . 73.42 110.946 -179.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . 0.625 HG22 ' HA ' ' A' ' 52' ' ' VAL . 10.4 m -148.87 167.0 3.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.329 0 CA-C-N 116.086 -0.506 . . . . 52.54 111.146 179.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.792 ' HB2' HD11 ' A' ' 7' ' ' LEU . 39.8 ttm-85 -138.35 119.68 14.76 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.2 -0.455 . . . . 64.04 110.811 -179.948 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 38.8 mm -70.29 108.8 2.47 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.292 0 CA-C-N 116.183 -0.462 . . . . 64.41 111.154 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ILE . . . . . 0.497 HG23 ' HG2' ' A' ' 56' ' ' ARG . 2.2 pt -128.31 140.3 49.57 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.189 -0.459 . . . . 72.42 111.122 179.878 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 6.7 t0 -78.76 121.91 25.35 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.187 -0.46 . . . . 74.53 110.848 179.86 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.699 HD23 ' CG ' ' A' ' 3' ' ' PHE . 0.2 OUTLIER -53.5 -30.02 39.11 Favored 'General case' 0 C--N 1.328 -0.326 0 CA-C-N 116.157 -0.474 . . . . 72.23 110.892 -179.976 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.404 ' HE3' ' HB3' ' A' ' 60' ' ' LEU . 14.3 mmt -85.36 -26.07 26.72 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.242 -0.435 . . . . 73.44 110.865 179.867 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -148.95 77.72 9.14 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.665 0.745 . . . . 64.41 110.884 179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' PRO . . . . . 0.737 ' O ' ' HB2' ' A' ' 67' ' ' ALA . 54.1 Cg_endo -69.7 -7.95 22.35 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.696 2.264 . . . . 72.2 112.376 179.993 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ALA . . . . . . . . . . . . . . . -94.42 -5.98 45.1 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.203 -0.453 . . . . 71.31 111.15 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' LYS . . . . . . . . . . . . . 2.1 mtpt -84.03 -41.49 17.17 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.201 -0.454 . . . . 65.42 110.867 -179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' TYR . . . . . 0.677 ' O ' HG12 ' A' ' 69' ' ' VAL . 23.4 m-85 -111.72 23.67 13.6 Favored 'General case' 0 C--N 1.328 -0.351 0 CA-C-N 116.213 -0.449 . . . . 73.2 110.957 -179.95 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ALA . . . . . 0.737 ' HB2' ' O ' ' A' ' 63' ' ' PRO . . . -81.34 -13.4 58.41 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.09 -0.505 . . . . 73.23 111.13 179.87 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 10.4 t -102.85 -22.22 13.91 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.177 -0.465 . . . . 64.15 110.825 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' VAL . . . . . 0.943 HG21 HD11 ' A' ' 80' ' ' ILE . 9.9 p -51.18 156.61 0.42 Allowed 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.108 -0.496 . . . . 73.25 111.097 -179.995 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ASP . . . . . . . . . . . . . 2.3 t0 -114.25 107.43 15.59 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.118 -0.492 . . . . 65.53 110.867 179.929 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.814 ' HB ' HG12 ' A' ' 52' ' ' VAL . 0.0 OUTLIER -70.8 -25.8 63.03 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.153 -0.476 . . . . 42.22 111.145 -179.879 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 5.6 t80 -62.97 -47.67 82.15 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-N 116.225 -0.443 . . . . 72.33 110.918 -179.909 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ASP . . . . . . . . . . . . . 19.4 m-20 -63.83 110.16 1.99 Allowed 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.136 -0.484 . . . . 65.3 110.87 179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -53.31 -27.61 24.07 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.197 -0.456 . . . . 73.25 110.855 -179.901 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 59.3 mt-10 -66.96 -54.36 22.7 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.22 -0.445 . . . . 52.05 110.87 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 9.9 mt-30 -59.77 -55.75 30.36 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.474 . . . . 74.34 110.878 -179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' VAL . . . . . 0.528 ' HA ' HD12 ' A' ' 80' ' ' ILE . 5.4 p -54.05 -32.81 23.37 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.261 0 CA-C-N 116.209 -0.451 . . . . 62.54 111.168 -179.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' MET . . . . . . . . . . . . . 15.0 mtm -67.15 -53.83 26.87 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.128 -0.487 . . . . 74.31 110.872 179.903 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 23.0 mttm -56.52 -38.37 71.73 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.224 -0.444 . . . . 74.21 110.891 179.978 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.943 HD11 HG21 ' A' ' 69' ' ' VAL . 16.5 mt -65.29 -52.95 45.95 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.312 0 CA-C-N 116.198 -0.456 . . . . 65.32 111.088 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' ILE . . . . . 0.788 HG23 ' HB ' ' A' ' 86' ' ' ILE . 94.7 mt -62.01 -36.48 74.33 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.3 0 CA-C-N 116.145 -0.479 . . . . 64.51 111.151 179.887 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' ASP . . . . . . . . . . . . . 11.0 t70 -70.19 -46.78 63.87 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.147 -0.479 . . . . 72.31 110.804 179.901 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLU . . . . . . . . . . . . . 53.3 mm-40 -63.53 -53.64 48.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.225 -0.443 . . . . 61.21 110.878 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' PHE . . . . . . . . . . . . . 28.2 m-85 -68.03 -14.8 63.25 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.132 -0.486 . . . . 74.33 110.85 -179.878 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 28.6 mmtm 60.78 55.49 3.23 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.144 -0.48 . . . . 72.13 110.93 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' ILE . . . . . 0.788 ' HB ' HG23 ' A' ' 81' ' ' ILE . 36.0 mt -82.5 131.98 53.72 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.601 0.715 . . . . 64.54 111.193 179.841 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' PRO . . . . . 0.416 ' O ' ' HB1' ' A' ' 30' ' ' ALA . 53.4 Cg_endo -69.78 166.94 25.93 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.665 2.244 . . . . 65.54 112.316 179.949 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -97.33 168.01 10.67 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 73.31 111.154 -179.952 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' VAL . . . . . . . . . . . . . 96.2 t -51.41 -54.91 9.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.306 0 CA-C-N 116.256 -0.429 . . . . 74.52 111.129 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' GLU . . . . . . . . . . . . . 38.0 mt-10 -51.65 -52.06 50.92 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.177 -0.465 . . . . 74.12 110.846 -179.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLN . . . . . . . . . . . . . 61.9 mm-40 -57.02 -42.44 80.42 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.117 -0.492 . . . . 72.44 110.898 -179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' TRP . . . . . . . . . . . . . 22.7 t90 -62.2 -39.39 92.57 Favored 'General case' 0 C--N 1.327 -0.374 0 CA-C-N 116.218 -0.446 . . . . 74.33 110.932 -179.985 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 2.0 mmpt? -65.12 -53.37 46.29 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.223 -0.444 . . . . 75.15 110.868 179.972 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -59.06 -37.23 76.56 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.217 -0.447 . . . . 43.41 110.872 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLN . . . . . . . . . . . . . 14.6 mt-30 -64.4 -54.42 33.07 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.188 -0.46 . . . . 75.32 110.94 -179.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' THR . . . . . . . . . . . . . 1.2 p -60.27 -44.17 95.55 Favored 'General case' 0 C--N 1.33 -0.244 0 CA-C-N 116.208 -0.451 . . . . 70.53 111.171 -179.945 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -57.99 -58.94 6.2 Favored 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.224 -0.444 . . . . 74.03 110.872 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' ARG . . . . . . . . . . . . . 54.5 mtt180 -57.04 -37.03 71.19 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.226 -0.443 . . . . 70.34 110.881 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' TYR . . . . . . . . . . . . . 41.5 t80 -61.87 -44.88 95.92 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.205 -0.452 . . . . 71.0 110.895 -179.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' LYS . . . . . . . . . . . . . 4.0 mtpp -76.94 -25.57 53.02 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.091 -0.504 . . . . 74.41 110.935 179.886 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -70.67 -177.46 1.55 Allowed 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.255 -0.43 . . . . 74.54 110.875 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' SER . . . . . . . . . . . . . 8.6 t 62.53 40.91 10.2 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.123 -0.489 . . . . 72.1 110.879 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' SER . . . . . . . . . . . . . 13.9 m -113.78 163.7 14.7 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.081 -0.509 . . . . 64.12 110.836 -179.815 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' ILE . . . . . . . . . . . . . 2.3 mt -58.94 134.07 24.04 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.112 -0.494 . . . . 75.15 111.137 179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.557 ' O ' HD13 ' A' ' 106' ' ' ILE . 2.7 mt-30 -179.43 165.18 1.38 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.162 -0.472 . . . . 65.43 110.846 179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 106' ' ' ILE . . . . . 0.557 HD13 ' O ' ' A' ' 105' ' ' GLN . 44.6 mm -132.29 112.33 19.35 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.127 -0.488 . . . . 71.35 111.151 179.911 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 107' ' ' GLY . . . . . . . . . . . . . . . 166.57 96.61 0.11 Allowed Glycine 0 N--CA 1.451 -0.314 0 C-N-CA 120.729 -0.748 . . . . 65.11 112.495 179.9 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 108' ' ' ASN . . . . . . . . . . . . . 5.3 p-10 -85.61 147.99 26.13 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-O 120.857 0.361 . . . . 62.44 110.858 -179.849 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . . . . . . . . . . . -177.46 52.36 0.1 Allowed Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.731 -0.747 . . . . 75.23 112.512 179.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 110' ' ' HIS . . . . . . . . . . . . . 41.0 m80 -115.63 167.35 10.99 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.823 0.344 . . . . 73.21 110.872 -179.935 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 111' ' ' GLY . . . . . . . . . . . . . . . -168.64 -156.85 10.77 Favored Glycine 0 N--CA 1.452 -0.276 0 C-N-CA 120.72 -0.752 . . . . 64.1 112.488 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 112' ' ' GLN . . . . . . . . . . . . . 73.2 mm-40 -82.37 154.94 24.99 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.791 0.329 . . . . 73.1 110.917 -179.871 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 113' ' ' SER . . . . . . . . . . . . . 1.3 p -83.52 -68.56 0.7 Allowed 'General case' 0 C--N 1.329 -0.326 0 CA-C-N 116.205 -0.452 . . . . 64.24 110.841 -179.771 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 114' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -143.7 155.91 44.36 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.138 -0.483 . . . . 74.33 110.924 -179.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 115' ' ' GLY . . . . . 0.616 ' O ' HD12 ' A' ' 116' ' ' LEU . . . -112.36 -19.92 6.87 Favored Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.698 -0.763 . . . . 64.3 112.487 -179.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 116' ' ' LEU . . . . . 0.616 HD12 ' O ' ' A' ' 115' ' ' GLY . 0.4 OUTLIER 33.01 49.87 0.2 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.784 0.326 . . . . 71.14 110.957 -179.88 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . . . . . . . . . 20.9 tp10 . . . . . 0 C--N 1.329 -0.298 0 CA-C-N 116.21 -0.45 . . . . 64.34 110.857 179.959 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' -9' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.316 0 N-CA-C 112.498 -0.241 . . . . 75.01 112.498 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' -8' ' ' LYS . . . . . . . . . . . . . 1.4 mppp? -120.02 -32.32 4.23 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.796 0.331 . . . . 73.51 110.902 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' -7' ' ' PHE . . . . . . . . . . . . . 20.8 m-85 -75.94 -74.89 0.2 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.238 -0.437 . . . . 74.02 110.886 179.977 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' -6' ' ' ILE . . . . . 0.747 HG23 ' OH ' ' A' ' 32' ' ' TYR . 3.9 mp 51.67 82.02 0.25 Allowed Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.579 0.704 . . . . 71.25 111.163 179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' -5' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_endo -69.71 117.88 5.35 Favored 'Trans proline' 0 C--N 1.341 0.146 0 C-N-CA 122.649 2.232 . . . . 74.14 112.388 179.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' -4' ' ' SER . . . . . . . . . . . . . 30.5 t -107.02 5.06 27.72 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.246 -0.433 . . . . 64.51 110.84 -179.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' -3' ' ' ARG . . . . . . . . . . . . . 2.0 mpp_? -51.62 162.72 0.69 Allowed Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.567 0.698 . . . . 73.14 110.888 -179.946 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' -2' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 -11.19 30.31 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.642 2.228 . . . . 71.11 112.32 -179.969 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' -1' ' ' ALA . . . . . . . . . . . . . . . 63.82 82.3 0.21 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.611 0.719 . . . . 73.31 111.083 179.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 0' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.78 141.18 44.47 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.663 2.242 . . . . 73.24 112.332 -179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' LYS . . . . . . . . . . . . . 22.1 mtmm -86.81 159.61 51.66 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.578 0.704 . . . . 65.1 110.89 179.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 166.9 26.04 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.658 2.239 . . . . 74.43 112.383 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 99.53 0.75 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.696 2.264 . . . . 73.22 112.343 179.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' SER . . . . . . . . . . . . . 2.0 m -93.03 166.59 12.29 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.235 -0.439 . . . . 65.24 110.819 -179.811 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' SER . . . . . . . . . . . . . 32.8 p -159.13 138.56 11.51 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.133 -0.485 . . . . 73.22 110.856 -179.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.122 -0.49 . . . . 71.23 111.081 179.891 . . . . . . . . 0 0 . 1 stop_ save_